data_2n5e_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 2n5e _Structure_validation_residue.Date_analyzed 2016-12-16 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 ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.841 0.353 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -57.5 11.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -58.03 -35.21 70.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.922 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -58.62 -52.07 67.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.94 -32.83 63.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.14 -25.96 68.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.168 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.76 -34.38 27.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.91 -27.76 14.61 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.441 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -48.62 -37.31 17.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.831 0.348 . . . . 0.0 110.921 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -59.65 -44.71 93.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.93 -49.61 73.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 6.4 mtp -58.16 -41.56 84.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.75 -50.61 73.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.58 -44.34 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -47.41 79.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.45 -49.67 75.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -54.34 -47.8 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.06 -34.92 79.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.94 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 69.3 t -66.41 -32.3 57.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -74.93 -52.91 10.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.54 -33.65 75.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -77.53 -33.42 54.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.67 -43.07 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.136 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 5.6 mm-40 -44.38 -65.05 0.66 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.586 0.708 . . . . 0.0 110.908 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.4 Cg_endo -69.77 -32.27 18.85 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.672 2.248 . . . . 0.0 112.332 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -58.94 -25.26 63.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.943 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.9 mt -72.5 -50.64 24.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.59 -34.17 77.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -47.74 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.69 -52.22 65.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.74 -45.59 85.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -63.2 -22.61 66.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -73.25 -47.15 45.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -28.41 68.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -66.27 -56.46 11.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -70.28 -34.63 73.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.44 -32.53 71.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -69.2 -54.2 16.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -35.03 79.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.869 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.64 -26.25 54.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -63.33 -55.35 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -73.61 -36.02 65.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.851 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 72.6 tp60 -67.93 -22.56 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -89.07 -36.23 15.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.86 -32.55 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.9 tt0 -59.56 -61.83 7.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.651 0.739 . . . . 0.0 110.859 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.6 Cg_endo -69.7 -52.32 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.677 2.251 . . . . 0.0 112.395 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 28.4 tp -69.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.89 -32.42 2.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.67 -44.66 32.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.814 0.34 . . . . 0.0 110.916 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.71 -42.63 81.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 35.4 mmt -66.82 -47.47 71.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -64.53 -42.94 95.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.8 -52.77 22.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -59.99 -34.9 73.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.844 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.67 96.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.099 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -63.27 -48.27 78.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.03 71.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.101 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -69.31 -50.69 44.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.41 -41.58 89.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -52.85 -52.26 57.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.93 75.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -39.27 74.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.947 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -45.12 75.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.908 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 22.6 m -55.88 -41.83 75.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.69 -31.5 32.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.13 -22.76 62.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.476 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -54.63 -62.56 3.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.577 0.703 . . . . 0.0 111.142 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.5 Cg_endo -69.83 -44.17 2.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -59.13 -31.37 68.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.938 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.8 t -56.71 -52.12 66.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.875 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.59 -47.57 80.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.871 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.8 -51.28 69.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -58.95 -44.71 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.926 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.21 -35.57 67.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -50.04 60.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.54 -40.11 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.6 tp -70.0 -49.82 47.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.92 -34.31 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.15 -34.22 56.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.125 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -62.11 -49.05 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.99 -49.31 65.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.39 -49.59 77.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.84 -46.8 78.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.86 -39.67 74.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -67.55 -28.17 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.868 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.75 -56.1 20.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.848 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.84 -27.53 65.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.16 -31.25 65.24 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.3 -48.7 66.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.48 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.25 -23.1 38.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.766 0.317 . . . . 0.0 111.054 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.81 -30.53 62.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.816 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -43.62 98.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.8 -48.82 43.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.097 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.94 -50.52 73.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -56.12 -46.7 79.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.919 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.19 -50.73 61.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.844 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.36 -31.01 68.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.123 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.41 -49.09 17.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.48 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.0 m -66.58 -48.36 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.147 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 26.3 pt-20 -70.86 -36.1 72.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -58.88 -47.64 84.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 mp -72.29 -29.8 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 58.0 m -56.91 -51.2 70.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 37.0 p -69.39 -50.35 46.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.151 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.41 -55.57 27.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 61.4 m -54.43 -35.88 63.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.875 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.85 -46.99 86.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -78.35 -27.84 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.04 -21.65 63.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.131 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.464 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -62.35 -60.71 9.26 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.561 0.696 . . . . 0.0 110.871 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 54.3 Cg_endo -69.72 -28.34 25.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.685 2.257 . . . . 0.0 112.366 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.78 -31.59 57.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.15 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.8 -38.39 73.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -54.19 -50.57 66.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.03 -31.18 58.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.849 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.59 -52.11 66.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -35.57 78.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.848 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -57.2 -48.91 77.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.866 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.422 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.82 -29.79 72.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.481 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.36 -32.4 73.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.8 OUTLIER -52.48 -61.65 4.31 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.595 0.712 . . . . 0.0 110.896 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.78 -43.79 2.44 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.661 2.241 . . . . 0.0 112.364 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 57.0 t -57.2 -55.08 22.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.14 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.73 -33.19 71.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -68.43 -34.98 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.93 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.92 83.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.858 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -65.6 -42.57 91.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.34 -44.84 90.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 42.9 t -55.54 -42.69 69.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.102 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -49.82 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -65.08 -38.5 90.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.96 -34.05 77.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.21 -30.98 65.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.88 56.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.069 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -67.18 -36.54 81.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.945 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.16 -35.97 69.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.78 -49.14 32.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.87 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.31 -37.27 80.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.9 m -71.04 -46.37 62.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.161 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -56.46 -53.93 51.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.87 -48.79 78.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.9 -34.53 69.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.45 -57.47 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.946 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.12 -35.3 71.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -58.47 -52.2 66.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -32.81 63.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.3 m -62.09 -25.92 67.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.168 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -34.39 27.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.9 -27.71 14.43 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.488 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 pp -48.7 -37.51 18.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.778 0.323 . . . . 0.0 110.913 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.64 -49.78 76.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -59.68 -44.87 93.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.92 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.73 -49.71 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 6.3 mtp -58.26 -41.42 84.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.79 -50.58 73.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.89 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.64 -44.43 90.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.28 -47.82 77.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.862 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.37 -49.39 76.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.35 -47.4 72.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.929 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.68 -34.95 79.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.9 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.48 -32.15 56.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.159 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -75.5 -53.29 8.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.91 75.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.104 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -77.76 -33.69 52.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.881 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . 0.422 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.0 OUTLIER -55.43 -46.43 78.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.561 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 5.2 mm-40 -43.48 -66.24 0.47 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.576 0.703 . . . . 0.0 110.913 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.561 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.73 -31.46 20.62 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 0.0 112.349 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . 0.422 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.5 t80 -58.66 -24.7 61.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.88 -50.14 15.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.929 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.83 -34.38 73.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.69 -47.56 69.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.09 -52.61 63.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.31 -46.16 84.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -62.2 -22.56 66.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.872 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -72.95 -47.41 45.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.89 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.86 -30.82 71.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -63.98 -56.4 15.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.14 -34.29 72.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -70.57 -31.68 68.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.904 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -69.95 -54.48 13.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.15 -35.52 81.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.51 -25.94 54.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.953 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -63.13 -55.57 24.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.932 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -74.43 -33.94 63.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.443 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 72.6 tp60 -69.58 -21.93 63.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -91.24 -36.31 13.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.68 -32.62 58.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.8 tt0 -60.67 -61.45 7.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.672 0.749 . . . . 0.0 110.89 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.75 -51.54 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.342 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 23.3 tp -70.84 -64.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.4 -32.21 1.76 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.462 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -77.74 -47.32 19.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 110.882 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 -45.68 78.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.5 mmt -64.91 -51.94 59.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.836 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.7 tpp85 -60.29 -43.59 96.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -66.75 -51.69 52.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.848 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.49 -31.91 70.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.48 -47.27 76.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.088 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 12.8 tpt85 -59.16 -45.3 91.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.65 -34.19 67.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.133 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -68.87 -50.05 53.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.83 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 8.7 p -65.23 -41.36 91.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -53.06 -51.95 60.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.05 -48.55 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -37.93 73.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -44.96 74.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 22.8 m -56.15 -41.86 76.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.164 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.56 -31.14 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.87 -22.64 62.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.481 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -54.84 -62.52 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.577 0.703 . . . . 0.0 111.121 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.76 -42.43 3.41 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.71 2.273 . . . . 0.0 112.35 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -60.74 -31.16 70.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.943 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.7 t -57.4 -51.85 67.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.829 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.23 -47.64 81.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.27 -51.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.877 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -58.86 -44.45 91.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.914 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.36 -36.07 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -49.44 64.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.25 -41.47 96.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 25.1 tp -69.27 -48.94 60.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.939 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.1 -34.34 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.102 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.41 57.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.124 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -61.98 -48.89 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.6 pp -67.32 -48.96 66.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -50.32 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.61 77.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.063 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -57.13 -39.39 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -68.3 -28.23 67.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -55.76 23.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.854 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.92 -27.38 65.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.24 -31.41 65.8 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.18 -48.81 66.09 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.473 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.15 -23.18 38.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.318 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.72 -30.53 62.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -43.77 98.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.84 -48.68 44.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.117 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.96 -50.41 73.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -56.38 -46.69 79.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.17 -50.22 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.85 -30.97 69.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.3 -48.95 18.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.26 -34.12 76.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.1 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.4 m -65.87 -48.66 70.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -70.91 -36.15 72.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.82 -47.56 84.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.37 -29.75 64.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.926 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 57.7 m -56.98 -51.09 70.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.848 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 36.6 p -69.37 -50.27 47.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.158 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.49 -55.58 27.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.879 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 61.3 m -54.51 -35.85 63.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.835 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.87 -46.88 86.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.888 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -78.47 -27.83 46.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.11 -21.74 63.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.474 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -62.27 -60.75 9.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.554 0.692 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.8 -28.25 25.28 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.711 2.274 . . . . 0.0 112.333 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.95 -31.55 56.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.126 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.62 -38.5 73.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.926 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -54.12 -50.43 66.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -75.88 -31.11 59.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.72 -52.22 66.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -35.46 78.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -57.21 -48.87 77.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -68.89 -29.82 72.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.493 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.31 -32.47 73.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.8 OUTLIER -52.45 -61.67 4.27 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.616 0.722 . . . . 0.0 110.923 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 54.0 Cg_endo -69.73 -43.83 2.45 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 0.0 112.398 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.23 -55.11 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.171 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -33.32 71.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.45 -34.92 76.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -47.96 83.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.856 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -65.64 -42.4 91.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.42 -44.9 89.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.867 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 43.0 t -55.53 -42.67 69.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.118 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.14 -49.82 76.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -65.1 -38.53 91.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.87 -34.09 77.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.907 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.26 -30.91 65.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.55 -50.75 57.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -67.31 -36.42 81.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.2 -36.06 69.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.73 -49.13 33.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.877 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -60.35 -37.24 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.925 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 98.1 m -70.99 -46.44 62.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.169 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 7.1 ttmt -56.45 -53.9 51.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.84 -48.81 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 29.6 mt -57.92 -34.55 69.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.925 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.838 0.351 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.85 -55.26 36.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.948 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.61 -33.81 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.885 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.18 -49.4 74.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.54 -34.01 76.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.8 p -73.11 -23.45 60.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -50.96 -31.96 19.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.32 -30.7 40.95 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 pp -51.67 -36.88 48.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.35 -49.67 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.876 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.23 -41.73 98.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.04 -48.08 81.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.3 mmt -62.5 -40.09 95.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -58.76 -50.24 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.869 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -60.56 -46.24 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -55.62 -47.59 76.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.888 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tp -58.15 -50.85 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.08 66.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.836 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -62.64 -37.96 88.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.893 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.34 -31.68 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.138 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -74.93 -53.93 8.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.895 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.57 -30.67 71.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.96 -36.11 42.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.7 t -58.34 -43.33 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.187 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.551 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.9 mm-40 -44.33 -65.23 0.64 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.61 0.719 . . . . 0.0 110.943 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.551 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.9 Cg_endo -69.8 -27.27 26.46 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -53.72 -57.29 11.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.65 -29.13 36.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.929 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.82 -47.04 73.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.04 -42.83 93.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -50.74 72.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.883 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -47.5 85.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -26.2 68.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -45.79 67.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.868 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -23.17 61.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -66.21 -64.83 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -63.4 -34.78 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.892 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -70.51 -30.07 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.874 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -65.65 -51.64 57.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.852 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -40.67 96.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -25.34 56.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -61.92 -54.97 34.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -71.18 -39.26 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.854 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -65.28 -25.67 67.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.35 -40.91 12.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.9 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.409 ' O ' ' HA3' ' A' ' 145' ' ' GLY . 59.0 t -57.61 -31.76 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.544 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.9 mt-10 -60.12 -65.09 2.31 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.587 0.708 . . . . 0.0 110.868 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.544 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 54.1 Cg_endo -69.73 -51.42 0.39 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.714 2.276 . . . . 0.0 112.374 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -63.61 1.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.907 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.18 -31.84 1.48 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.481 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -75.37 -43.58 49.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 0.0 110.857 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -71.83 -37.37 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -67.54 -47.74 69.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.834 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.3 tpp180 -66.31 -39.92 89.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.87 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -71.37 -51.34 24.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -62.46 -38.27 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.22 -42.47 99.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.79 -50.91 70.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.05 70.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.084 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.16 -50.6 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 10.7 p -67.34 -35.53 74.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.129 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -57.3 -51.25 70.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.01 56.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.087 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 22.2 tp -56.76 -42.57 79.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.47 -38.88 81.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.88 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 61.8 m -56.95 -47.61 80.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.09 -34.9 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.87 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.3 tp -72.31 -15.08 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.472 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -62.3 -62.05 6.5 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.609 0.719 . . . . 0.0 111.15 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.73 -39.4 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.364 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -63.16 -34.22 77.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.95 -48.58 73.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -62.02 -49.39 76.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.46 -51.07 68.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 31.7 tp -60.62 -50.04 75.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.57 -34.01 76.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.833 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.23 79.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -49.02 38.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.867 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -51.47 47.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.31 -43.02 74.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.109 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.95 -39.35 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.05 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -33.43 75.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.887 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.76 -50.17 26.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.39 -50.93 57.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.27 76.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.086 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 18.8 tp -63.79 -34.78 78.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -65.28 -33.54 76.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.82 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.53 -45.16 77.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -67.56 -26.28 66.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.12 -33.57 37.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.445 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.1 -32.3 35.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.502 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.25 -25.74 42.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 111.133 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.75 -35.25 65.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -37.18 86.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.907 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.33 38.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.063 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -49.08 77.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.47 -42.69 92.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.84 -50.16 66.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.96 -30.92 70.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.088 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.36 -49.73 18.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.66 -34.82 77.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.156 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.1 m -64.23 -47.67 78.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.14 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.87 -37.77 79.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -42.85 90.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -30.95 64.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 20.3 m -57.18 -51.02 70.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.865 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 4.8 p -67.74 -50.38 57.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.159 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.0 tp -55.06 -53.06 60.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 14.1 m -54.64 -36.17 64.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.814 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -46.27 88.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -28.85 48.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.896 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.08 62.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.473 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 4.4 tptt -61.07 -60.37 10.85 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.589 0.709 . . . . 0.0 110.893 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.71 -29.16 24.54 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.694 2.263 . . . . 0.0 112.41 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.54 -29.82 56.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.085 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tt -72.54 -38.66 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.91 -51.22 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.883 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.75 -31.25 61.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.91 -52.46 62.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.95 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -63.7 -37.76 88.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.874 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -56.67 -48.32 77.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.405 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -66.75 -29.25 74.42 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.457 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.88 -33.07 74.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.836 0.351 . . . . 0.0 110.883 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.462 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.1 mp -48.3 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.583 0.706 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.2 Cg_endo -69.78 -37.72 8.74 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.683 2.255 . . . . 0.0 112.324 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.55 -54.87 27.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -34.98 74.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.22 -34.62 78.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.15 -48.43 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.31 -43.18 70.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -62.49 -48.86 77.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.828 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.74 -38.78 59.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.56 -50.1 75.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.865 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.78 -38.48 90.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.22 -34.76 79.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 10.8 m -70.14 -30.42 67.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.829 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.16 48.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.123 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -69.2 -38.99 78.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.65 -39.65 84.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -72.26 -48.62 41.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.7 -35.89 69.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 93.9 m -70.73 -47.33 60.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.109 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -53.79 52.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -61.73 -48.72 79.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.83 -35.09 70.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 179.919 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.886 0.374 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.86 -55.34 35.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.52 -33.82 76.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.876 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -49.51 73.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.46 -34.05 76.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.877 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 28.8 p -73.14 -23.4 60.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.123 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.03 -31.93 19.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.893 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.42 -30.7 41.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.476 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.5 pp -51.65 -36.79 47.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -58.49 -49.61 76.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.11 -42.01 98.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.923 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.74 -48.39 79.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.2 mmt -62.27 -40.0 94.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 44.4 m -58.63 -50.23 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.835 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -60.45 -46.52 89.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -55.44 -47.97 75.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.891 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.86 -50.78 72.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.11 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.12 -36.66 84.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.925 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.45 -31.76 55.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -75.21 -54.93 6.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.18 72.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.68 -36.57 43.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 1.3 t -54.22 -47.45 67.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.108 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.57 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.0 mm-40 -42.68 -66.76 0.39 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.562 0.696 . . . . 0.0 110.904 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.57 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.69 -24.32 30.12 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.703 2.268 . . . . 0.0 112.339 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -53.54 -54.98 29.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.941 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.46 -28.36 66.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.87 -48.49 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.848 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.28 -43.94 84.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -51.54 67.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.877 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -47.52 85.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.25 -25.48 64.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.97 -48.93 41.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.918 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -25.63 67.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -68.02 -66.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.9 -35.51 76.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.858 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -70.96 -29.3 65.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.902 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -65.49 -51.37 60.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.826 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -39.11 93.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -25.72 56.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.895 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -64.23 -55.58 20.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.974 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -69.4 -38.61 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -66.6 -24.51 66.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -91.79 -42.56 10.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . 0.4 ' O ' ' HA3' ' B' ' 145' ' ' GLY . 62.2 t -56.98 -31.47 36.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.527 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mt-10 -61.45 -64.85 2.61 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.649 0.738 . . . . 0.0 110.904 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.527 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.4 Cg_endo -69.74 -51.82 0.36 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -63.95 1.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' B' ' 119' ' ' VAL . . . -42.99 -31.0 1.11 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -77.2 -45.21 27.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -70.24 -43.84 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -64.9 -51.2 63.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -62.09 -41.09 97.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.857 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -68.31 -50.92 50.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.815 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -62.26 -33.73 75.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.57 -49.68 72.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.09 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -56.66 -49.54 74.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.897 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.99 -32.93 72.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.106 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.5 -50.15 60.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.837 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.3 -35.55 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.13 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -57.6 -50.78 72.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.1 58.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.109 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 22.0 tp -57.37 -42.21 81.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -39.54 84.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 86.1 m -57.25 -46.88 82.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.48 -34.94 47.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 tp -72.4 -15.37 61.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.93 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.469 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -62.13 -61.96 6.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.582 0.706 . . . . 0.0 111.076 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.73 -38.7 7.5 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -63.86 -34.95 79.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.02 -48.37 76.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -62.2 -49.24 76.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.867 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.4 -51.16 68.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.912 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.61 -50.1 74.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.35 -33.9 76.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -35.33 80.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -48.82 41.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.38 48.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.888 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.56 -42.75 75.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.04 -39.11 63.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.142 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -34.15 77.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.892 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -49.35 33.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -67.19 -50.48 60.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.71 80.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 19.1 tp -64.36 -34.51 78.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -66.62 -33.77 76.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -44.71 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.875 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -68.05 -26.09 65.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.09 -33.59 37.7 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.482 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.0 -32.38 34.58 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.459 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.68 42.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.339 . . . . 0.0 111.128 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.73 -35.69 65.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -37.35 86.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.85 -49.25 39.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.137 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -48.44 79.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.88 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.92 -42.83 94.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.88 -49.99 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.83 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.07 -30.91 70.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.53 -49.6 18.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.71 -35.03 78.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 63.5 m -64.16 -47.56 79.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.163 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.85 -37.88 79.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.847 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -42.74 90.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.849 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.0 -30.9 64.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 20.2 m -57.28 -50.95 71.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 4.9 p -67.68 -50.38 57.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.9 tp -55.09 -53.04 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 13.9 m -54.71 -36.12 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.828 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -46.23 88.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.859 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -28.78 48.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.15 62.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.482 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 4.5 tptt -61.12 -60.3 11.06 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.564 0.697 . . . . 0.0 110.876 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.7 Cg_endo -69.8 -29.17 24.09 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.663 2.242 . . . . 0.0 112.3 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -29.76 56.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.109 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.39 -38.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.84 -51.03 64.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.81 -31.27 61.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.93 -52.45 62.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -63.88 -37.6 88.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -56.64 -48.4 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.407 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -66.79 -29.3 74.49 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.482 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.74 -33.13 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.886 0.374 . . . . 0.0 110.956 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.475 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.1 mp -48.28 -60.79 3.87 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 0.0 110.916 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.8 Cg_endo -69.72 -37.72 8.88 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.675 2.25 . . . . 0.0 112.328 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.65 -54.81 28.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.51 -35.12 75.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -34.61 78.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.844 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.18 -48.46 79.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.789 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.27 -43.21 70.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.1 tttm -62.49 -48.83 77.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 24.8 t -56.69 -38.82 59.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.55 -50.13 74.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.82 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -38.48 90.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.907 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.23 -34.82 79.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.937 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 10.4 m -70.05 -30.41 67.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.45 -50.22 47.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -69.12 -39.03 79.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -67.62 -39.56 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.33 -48.62 40.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.66 -35.92 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 93.5 m -70.67 -47.35 60.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -53.76 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -61.82 -48.63 79.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 28.0 mt -57.86 -35.06 70.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.921 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.936 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.804 0.335 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.74 -55.13 36.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.31 -38.29 73.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.03 -51.66 67.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -30.72 61.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.4 m -59.25 -22.08 60.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.01 -34.52 13.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.88 -27.15 20.11 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.469 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.31 -35.65 12.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.801 0.334 . . . . 0.0 110.893 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -50.22 74.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.13 -43.81 98.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.41 -49.28 74.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.63 -41.58 86.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -58.62 -50.6 73.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.837 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.83 -45.08 90.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.16 -46.84 79.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.23 -50.39 73.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.78 -48.27 69.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.68 -35.57 81.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.886 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 63.2 t -65.62 -32.29 57.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.162 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.39 -52.77 11.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.73 -33.27 73.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.088 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -78.03 -33.15 51.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.7 t -58.82 -42.68 86.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.178 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 mt-30 -44.6 -64.89 0.71 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.592 0.71 . . . . 0.0 110.918 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.8 -32.9 17.52 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.717 2.278 . . . . 0.0 112.317 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -59.11 -25.22 63.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.951 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.1 -50.88 20.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.8 -32.52 73.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.896 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -47.4 65.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.913 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -56.09 -52.41 64.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.23 -47.54 76.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -61.0 -22.75 64.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.919 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -74.32 -45.98 43.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -30.53 71.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -66.18 -55.88 14.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -69.65 -34.46 74.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.94 -31.73 68.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.03 -54.24 16.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.897 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.51 -35.13 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.62 -25.91 54.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -65.25 -54.62 26.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -41.31 65.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.403 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 39.3 tt0 -62.01 -25.81 67.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -84.81 -39.23 18.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.45 -32.49 48.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.157 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.541 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 4.7 mt-10 -57.61 -64.78 2.28 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.645 0.736 . . . . 0.0 110.921 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.8 Cg_endo -69.74 -51.14 0.4 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.699 2.266 . . . . 0.0 112.356 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.2 tp -67.27 -64.3 0.88 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.23 -32.67 3.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.451 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -74.36 -43.84 54.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -70.89 -35.49 72.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -49.96 64.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -68.12 -37.13 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.879 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -71.24 -53.57 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -61.44 -37.05 82.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.848 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.22 96.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.113 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -49.65 73.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.99 -32.39 69.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -69.82 -50.87 38.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.4 p -67.09 -41.55 87.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.131 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -53.33 -52.63 58.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.31 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.109 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 mp -56.77 -45.3 82.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -63.31 -44.09 95.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.882 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 32.2 m -56.09 -40.78 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.41 -31.23 33.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.34 -22.27 63.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.482 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -54.97 -62.7 3.81 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.549 0.69 . . . . 0.0 111.114 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.83 -45.85 1.4 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.67 2.247 . . . . 0.0 112.347 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.55 -29.13 64.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -52.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.836 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.86 -33.18 75.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.839 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.71 -51.91 30.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.846 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.29 -49.34 64.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.88 -35.95 69.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.87 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -41.9 82.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -72.31 -40.52 67.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.865 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -50.56 38.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.928 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.62 -40.96 80.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.092 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.1 -41.83 61.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.099 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -65.72 -34.15 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.54 -50.07 48.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -69.4 -35.57 75.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.13 -49.17 53.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.125 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.9 -43.15 81.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -70.28 -30.86 67.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.881 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -55.48 31.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.85 -26.79 68.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.74 -34.47 44.39 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.69 -33.3 41.61 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.498 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.39 42.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.32 . . . . 0.0 111.092 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -73.1 -32.67 65.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -39.49 93.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.958 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.38 35.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.08 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -49.56 75.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -57.99 -44.24 87.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -53.64 -49.37 68.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.878 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.41 -31.3 70.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.096 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -49.6 16.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.57 -34.7 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.114 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 86.1 m -65.76 -47.57 74.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.148 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.44 -36.16 76.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.91 -46.44 87.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.837 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -30.13 64.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.03 -51.11 70.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.813 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.64 -50.59 50.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.32 -55.07 32.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.913 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 68.1 m -54.23 -36.03 63.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.84 -46.53 87.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -29.83 52.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.38 -21.89 64.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.506 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 2.1 mttt -60.93 -63.08 4.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.562 0.696 . . . . 0.0 110.921 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.2 Cg_endo -69.78 -26.82 27.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.355 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.04 57.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -72.07 -37.18 69.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.945 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.25 -50.85 66.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -31.06 57.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.838 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.44 -50.93 70.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -35.84 78.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -57.06 -48.94 77.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.418 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.97 -29.78 72.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.459 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -32.66 74.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.85 0.357 . . . . 0.0 110.891 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.475 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -52.34 -61.67 4.23 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.3 Cg_endo -69.8 -43.85 2.38 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.28 . . . . 0.0 112.332 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 54.1 t -57.27 -55.2 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.128 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.65 -33.25 71.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.955 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -68.56 -34.86 76.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 70.6 m -59.96 -47.87 84.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -66.01 -41.93 90.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -45.13 87.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.93 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.38 -42.82 69.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.152 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -49.94 75.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.841 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -64.78 -37.59 88.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.861 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -64.93 -34.52 78.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.919 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.08 -30.48 65.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.02 -50.84 53.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.109 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.43 -35.57 79.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -39.51 69.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.91 -49.2 31.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -57.71 -41.44 81.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.966 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 80.5 m -65.8 -45.56 81.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.118 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.74 53.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 10.8 mtmm -57.78 -49.55 76.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.926 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.36 -35.11 71.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.904 0.383 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.77 -55.16 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.28 -38.3 73.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -51.5 67.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.908 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 93.9 m -59.23 -21.96 60.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.141 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.24 -34.46 15.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.98 -27.15 20.96 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.509 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.39 -35.44 12.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 110.903 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -50.23 74.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -43.82 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.902 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.34 -49.33 74.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.74 -41.34 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.93 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -58.72 -50.48 73.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.92 -45.42 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -47.04 77.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -50.21 73.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -48.12 70.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.866 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.81 -35.6 81.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.841 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.68 -32.34 57.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.83 -53.07 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.893 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 -34.65 74.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.074 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -77.96 -33.48 51.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.909 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . 0.403 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.4 t -55.94 -45.68 80.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.105 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.566 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.9 mt-30 -43.68 -66.16 0.49 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.566 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.8 -32.48 18.34 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.33 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . 0.403 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.0 t80 -58.76 -24.27 61.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.41 -50.07 15.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -59.87 -32.51 70.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.22 -47.11 62.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -55.84 -53.1 60.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.48 -47.66 78.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -60.87 -22.38 64.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -73.51 -47.54 40.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.78 -31.81 73.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -64.03 -56.15 17.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.909 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -70.47 -34.26 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.73 -32.43 69.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -54.21 15.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.841 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.97 -35.6 81.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.67 -25.65 53.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.935 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -65.16 -54.84 23.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.937 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.13 -37.72 66.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -65.62 -24.35 67.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.923 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -88.02 -40.11 14.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.11 -32.75 51.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.153 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 4.7 mt-10 -58.45 -64.52 2.74 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.667 0.746 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.8 Cg_endo -69.78 -50.68 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.661 2.241 . . . . 0.0 112.304 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.21 -64.84 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.39 -31.02 3.21 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.467 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -76.51 -44.52 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 110.918 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -70.44 -42.41 71.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 15.8 mmt -65.07 -53.35 47.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.885 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -61.16 -42.34 98.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.839 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -66.43 -51.87 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.79 -32.05 71.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.17 -47.52 76.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.085 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -45.32 91.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.33 -33.67 67.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.077 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -69.68 -50.19 46.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.8 p -65.14 -41.56 92.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -53.67 -52.06 61.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.45 75.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.92 -43.38 81.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -63.46 -44.37 94.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 25.1 m -56.25 -41.39 75.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.148 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -31.13 39.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.13 -22.37 63.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.477 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -54.89 -62.86 3.53 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.579 0.704 . . . . 0.0 111.151 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.3 Cg_endo -69.76 -44.34 2.13 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.675 2.25 . . . . 0.0 112.337 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -58.66 -29.91 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.9 67.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.83 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.48 -33.51 76.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.73 -51.89 30.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 20.5 tp -67.18 -49.34 65.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.921 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.96 -36.22 70.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.6 83.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -72.38 -40.75 67.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.18 -50.35 41.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.974 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.79 -40.73 80.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.21 -41.31 61.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.075 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -66.16 -34.01 77.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.864 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.62 -49.72 51.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.933 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -69.27 -36.42 77.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.906 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -69.68 -49.14 56.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 2.2 tt -57.55 -41.81 81.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -71.73 -31.42 66.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.44 -55.27 33.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.862 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.55 -26.8 68.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.73 -34.58 44.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.462 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.52 -33.37 40.52 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.47 42.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.75 0.309 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -73.02 -32.62 65.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -39.63 93.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.22 36.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -49.5 75.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.04 -44.37 87.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.919 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -53.5 -49.39 67.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.29 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -49.65 16.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.59 -34.68 78.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 85.4 m -65.68 -47.56 75.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.113 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.49 -36.23 76.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.85 -46.39 87.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -30.16 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.01 -51.02 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.61 -50.61 50.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.37 -55.08 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 68.0 m -54.24 -36.06 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.86 -46.51 87.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -30.02 52.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.76 64.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.1 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.513 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 2.1 mttt -61.01 -63.23 4.57 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.586 0.708 . . . . 0.0 110.865 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.77 -26.8 27.15 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 0.0 112.31 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -31.98 57.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.02 -37.18 69.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.13 -50.85 65.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.865 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.32 -31.16 58.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.32 -50.97 70.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.9 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -35.9 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.869 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.07 -48.91 77.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.417 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -68.96 -29.78 72.4 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.494 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.18 -32.63 74.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 0.0 110.908 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.9 OUTLIER -52.39 -61.7 4.21 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.612 0.72 . . . . 0.0 110.885 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.69 -43.96 2.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.719 2.279 . . . . 0.0 112.364 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 57.1 t -57.24 -55.15 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.109 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.72 -33.23 71.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -68.49 -34.84 76.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 70.7 m -60.02 -47.85 84.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -65.84 -42.16 90.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -44.93 88.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.889 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 42.9 t -55.46 -42.86 69.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.159 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.22 -49.96 75.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -64.69 -37.7 88.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.899 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -64.86 -34.5 78.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.1 -30.51 65.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.96 -50.86 53.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.41 -35.64 79.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.0 -39.61 69.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.81 -49.15 32.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.897 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -57.79 -41.45 82.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.908 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 81.3 m -65.77 -45.53 82.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.76 53.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 10.7 mtmm -57.82 -49.51 76.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.48 -35.02 71.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.885 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.865 0.364 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.07 -55.25 27.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.53 -38.7 81.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.941 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.07 -50.94 69.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.21 -32.62 61.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.872 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.9 m -65.92 -23.92 66.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.47 -33.66 22.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.98 -30.73 54.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.487 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -51.73 -36.31 46.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.807 0.336 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -49.79 75.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -41.3 96.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -48.34 81.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -40.05 96.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -50.6 73.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.78 -46.01 91.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.92 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -56.1 -47.59 77.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.875 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -51.47 69.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -47.8 65.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.26 -38.41 91.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.0 -31.75 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -74.96 -54.26 7.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.2 -30.16 70.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.156 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -79.0 -36.64 40.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.1 t -57.03 -45.0 83.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.122 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.552 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.3 mm-40 -43.84 -65.43 0.59 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.578 0.704 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.552 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 54.0 Cg_endo -69.76 -25.63 28.38 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.639 2.226 . . . . 0.0 112.367 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -53.56 -58.14 8.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -54.92 -28.57 51.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.02 -47.62 73.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -44.19 87.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.863 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -50.52 72.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.89 -47.35 86.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -60.93 -26.24 67.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.927 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -45.27 62.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.895 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . 0.514 ' HE1' ' NH1' ' B' ' 149' ' ' ARG . 0.0 OUTLIER -69.96 -23.3 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -68.12 -64.48 0.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -62.94 -34.97 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.64 -30.32 66.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.924 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 45.3 ttp -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.9 -41.31 97.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -24.79 55.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.958 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -63.66 -55.05 26.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -69.95 -42.72 72.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.33 -26.61 67.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.876 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -89.63 -37.81 14.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.401 ' O ' ' HA3' ' A' ' 145' ' ' GLY . 50.8 t -58.47 -31.73 43.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -60.91 -64.78 2.71 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.67 0.748 . . . . 0.0 110.903 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.75 -51.03 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.677 2.251 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.9 -63.48 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.401 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -44.11 -30.72 1.9 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.524 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.32 -43.72 60.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.859 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -74.95 -33.92 61.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -48.65 68.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -37.15 77.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -71.0 -50.82 30.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.7 -37.97 89.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.13 -43.51 98.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -62.18 -50.62 71.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.29 -30.29 69.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.118 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 35.7 t60 -68.36 -50.44 53.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.848 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.9 p -66.65 -37.26 79.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.161 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -57.2 -52.94 63.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.91 -49.15 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 6.2 mt -56.43 -49.57 74.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 23.5 mmt-85 -60.17 -39.4 86.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 95.0 m -57.3 -48.04 79.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -76.14 -35.14 59.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.84 -15.64 62.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.478 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -61.19 -62.43 5.98 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 0.0 111.133 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.478 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.8 -41.37 4.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.73 2.286 . . . . 0.0 112.323 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -61.57 -34.73 76.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.6 t -60.99 -45.76 93.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -62.56 -50.92 69.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.859 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.32 -51.43 69.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.25 -46.57 86.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.8 tpt85 -60.39 -38.09 82.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -34.65 78.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.14 -49.0 60.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.77 -50.92 30.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.945 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.2 -45.84 72.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.35 -36.03 71.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -32.35 72.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 4.8 tp -72.26 -50.88 23.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.48 -45.0 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.69 93.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 55.4 tp -58.81 -40.87 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -66.26 -31.82 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -55.3 33.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -65.74 -26.23 67.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.19 -33.66 38.55 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.502 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.23 -32.7 37.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.507 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.22 42.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.738 0.304 . . . . 0.0 111.078 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -72.91 -34.36 66.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.882 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.67 86.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.58 36.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.01 -48.77 77.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.892 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.27 -43.93 92.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -53.27 -50.58 64.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.851 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.15 69.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -49.31 18.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.55 -36.72 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.081 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 21.1 p -63.17 -47.58 82.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.148 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -35.96 80.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.55 -45.95 87.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.64 -30.24 65.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.943 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -50.9 71.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 54.3 m -68.18 -50.15 56.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.11 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.58 -54.05 46.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 67.0 m -54.59 -36.14 64.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.61 -47.78 83.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.905 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.2 -28.07 48.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.845 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.16 -22.08 63.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.152 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.494 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -60.22 -62.59 5.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.577 0.703 . . . . 0.0 110.908 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.494 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.81 -27.11 26.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.274 . . . . 0.0 112.354 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.82 -30.94 56.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.126 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.99 -37.52 66.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.879 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.06 -50.81 65.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.885 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.01 -30.71 61.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -51.35 70.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -37.18 81.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.73 -49.09 76.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.423 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.19 -29.42 73.3 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -62.98 -32.93 74.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 110.928 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -52.17 -61.77 4.03 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.583 0.706 . . . . 0.0 110.935 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.72 -43.74 2.52 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.703 2.269 . . . . 0.0 112.338 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.26 -53.69 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.182 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.63 -33.52 71.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.0 -36.0 82.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 47.7 t -61.84 -48.32 81.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.13 -41.06 82.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.919 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.76 -45.44 86.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.929 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 28.9 t -56.8 -41.57 75.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.148 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.96 -50.12 75.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.05 -38.08 84.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.09 -35.87 79.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.48 -30.53 67.36 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.84 -51.29 57.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.12 -41.05 74.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.29 -43.4 98.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.28 -47.57 76.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.85 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -53.99 -39.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 13.0 m -67.04 -44.8 79.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.11 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -55.5 33.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.31 -49.07 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.84 -39.81 78.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 52.7 t30 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.893 0.378 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.2 tp -63.14 -55.26 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.92 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.52 -38.71 81.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.04 -50.96 69.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.947 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -75.18 -32.69 61.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.885 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -65.77 -23.91 66.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.4 -33.63 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.95 -30.79 54.66 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -51.68 -36.42 46.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.8 0.333 . . . . 0.0 110.931 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -49.78 75.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.825 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -41.49 97.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -48.61 80.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -40.22 96.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -50.4 73.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.49 -46.73 88.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.85 -47.91 76.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.9 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.8 -51.57 69.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.86 -47.96 64.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.45 -37.31 86.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 88.6 t -65.7 -32.03 56.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.163 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -75.08 -55.49 5.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.945 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.98 -31.75 70.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.068 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt -78.78 -37.44 41.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 1.6 t -51.79 -51.6 26.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.172 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.576 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mm-40 -39.88 -67.27 0.29 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 110.895 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.576 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.76 -20.65 34.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 0.0 112.37 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.48 -55.55 24.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -62.24 -28.39 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.969 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -49.23 78.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.07 -43.84 77.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.814 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.25 -50.81 71.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.844 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.7 -47.71 84.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -59.53 -25.41 64.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.39 -47.34 50.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.962 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -25.92 66.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -67.51 -65.58 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -60.97 -35.65 77.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.41 -29.9 66.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.886 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 39.3 ttp -65.63 -51.13 61.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.06 -41.27 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mp -75.83 -24.65 55.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -63.74 -55.09 25.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -71.14 -39.55 71.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -25.67 68.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -91.8 -39.11 11.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.85 -31.29 44.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.148 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.531 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -61.58 -64.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.662 0.744 . . . . 0.0 110.889 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.531 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.76 -50.61 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -63.82 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.63 -30.35 1.46 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.502 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.61 -45.0 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.815 0.34 . . . . 0.0 110.907 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -74.56 -35.78 63.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.37 47.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . 0.514 ' NH1' ' HE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -65.57 -36.83 84.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.876 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.47 -50.72 50.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 2.8 ttp85 -64.14 -34.44 78.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.38 70.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -56.67 -50.04 73.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.97 70.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.11 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -68.75 -49.98 54.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.03 -36.76 78.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.71 -52.06 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.47 -49.51 68.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 6.2 mt -56.8 -48.03 78.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.82 -40.12 91.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 92.5 m -57.47 -46.69 83.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.141 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -76.49 -35.73 58.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.84 -15.76 62.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.48 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -60.78 -62.17 6.5 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.571 0.7 . . . . 0.0 111.108 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.6 Cg_endo -69.79 -42.24 3.54 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.663 2.242 . . . . 0.0 112.336 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -60.81 -33.55 73.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.4 t -61.49 -46.22 90.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.821 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -62.41 -48.9 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.96 -51.87 67.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 11.3 tp -61.2 -49.19 78.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -62.31 -34.56 76.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.7 -34.77 79.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -47.11 57.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.0 tp -70.17 -51.12 33.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.08 -45.12 75.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.3 -34.81 70.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.125 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -32.5 71.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.886 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 4.9 tp -71.76 -50.22 31.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -67.35 -43.21 82.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.893 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.39 90.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.079 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 54.9 tp -60.03 -38.28 82.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -69.67 -32.22 70.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -55.13 35.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.885 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.62 -26.15 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.14 -33.75 38.36 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.481 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.12 -32.8 36.38 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.502 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.17 42.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.116 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -73.03 -34.29 66.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.836 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.71 87.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.02 -49.39 37.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.119 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.06 -48.7 77.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.42 -43.77 92.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.892 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -53.46 -50.42 65.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.851 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.03 -31.17 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.082 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.63 -49.24 19.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.79 83.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.091 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 21.2 p -63.12 -47.45 82.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.168 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -35.94 80.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.87 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.65 -45.89 88.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.844 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.62 -30.28 65.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -50.94 71.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.836 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 54.1 m -68.14 -50.07 57.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.164 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.64 -53.93 48.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.953 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 66.7 m -54.75 -36.07 64.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.868 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.67 -47.77 83.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.17 -28.03 48.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.9 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.12 63.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.503 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -60.13 -62.66 5.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.524 0.678 . . . . 0.0 110.927 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.3 Cg_endo -69.81 -27.06 26.72 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.666 2.244 . . . . 0.0 112.338 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.92 -30.88 56.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.094 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.08 -37.41 66.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -53.89 -50.81 65.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -30.92 61.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.65 -51.57 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.898 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -37.57 82.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.68 -49.07 76.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.415 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -67.88 -29.51 73.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.49 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.03 -32.79 74.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.939 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.3 mp -52.18 -61.74 4.07 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.609 0.719 . . . . 0.0 110.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.77 -43.69 2.5 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.671 2.247 . . . . 0.0 112.325 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 54.6 t -57.27 -53.86 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.106 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.5 -33.55 71.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.93 -35.91 82.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.889 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 47.8 t -61.97 -48.3 80.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -68.13 -41.07 82.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.8 -45.49 86.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.887 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 27.3 t -56.71 -41.65 75.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.105 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.02 -50.07 75.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.828 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -38.15 85.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.07 -35.85 79.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.47 -30.53 67.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.83 -51.41 55.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.09 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.94 -41.15 74.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.26 -43.55 97.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.866 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.22 -47.51 76.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -54.03 -39.2 65.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.92 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 12.9 m -66.96 -44.68 79.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.164 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -55.6 31.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.874 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.2 -49.08 78.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -39.78 78.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.9 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 52.8 t30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.3 tp -62.33 -55.4 28.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.26 -33.28 75.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -44.37 81.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.17 -37.48 63.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 36.3 p -61.84 -21.04 64.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.099 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.09 -31.7 8.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.82 -29.85 43.01 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.466 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.17 -35.25 35.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.845 0.355 . . . . 0.0 110.947 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -50.1 74.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.92 -40.87 95.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -47.41 85.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -40.79 98.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.86 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -58.32 -50.68 72.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.866 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -45.27 95.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.92 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -48.01 78.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.5 -51.61 68.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.15 -47.86 65.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -63.74 -36.8 85.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.852 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 77.6 t -65.8 -32.11 56.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.087 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -74.94 -54.28 7.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.39 71.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.118 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.89 -35.94 42.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.1 t -57.56 -44.79 85.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.118 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.548 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.4 mt-30 -43.81 -65.18 0.62 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.584 0.707 . . . . 0.0 110.894 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.3 Cg_endo -69.71 -26.22 28.02 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.341 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -52.93 -58.48 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 pp -54.83 -27.84 45.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -43.81 85.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.87 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -71.97 -37.26 69.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.68 -53.23 58.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.894 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -42.86 98.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -62.56 -28.05 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.89 -45.79 60.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -24.01 64.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -66.75 -65.22 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.62 -35.47 77.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -71.1 -29.77 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -64.42 -51.29 63.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.883 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.48 -41.02 98.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.69 -24.12 56.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.68 -55.76 20.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -63.44 -24.88 68.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.892 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -92.73 -32.99 14.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.421 ' O ' ' HA3' ' A' ' 145' ' ' GLY . 42.6 t -62.6 -32.07 54.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.158 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 9.4 tt0 -63.28 -61.7 6.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.3 Cg_endo -69.77 -51.21 0.4 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.702 2.268 . . . . 0.0 112.329 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.68 -62.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.937 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.421 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.72 -30.72 1.61 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.474 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.79 -43.73 53.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.804 0.335 . . . . 0.0 110.855 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -37.4 64.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -48.99 67.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.9 tpp85 -67.77 -38.4 83.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.868 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -70.42 -50.87 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -38.06 89.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.839 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.74 98.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.058 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -60.96 -51.25 70.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.857 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.02 -29.97 69.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.117 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -67.85 -51.07 52.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.84 -39.47 84.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.61 -52.56 61.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.82 -48.3 74.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.108 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -42.57 78.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.832 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.8 -47.49 82.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.112 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -78.83 -35.51 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.8 tt -71.68 -15.4 62.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.48 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -61.25 -62.69 5.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 0.0 111.142 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.76 -40.81 4.89 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -61.92 -34.64 76.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -61.27 -46.19 91.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.874 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.54 -48.95 78.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.889 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.08 -52.01 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 12.4 tp -59.58 -50.14 75.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -63.71 -34.38 77.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.9 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -35.38 79.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.19 -50.82 24.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.96 -51.72 56.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.916 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.91 -44.83 74.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.061 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.71 -35.09 70.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -65.84 -33.1 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.4 tp -73.8 -51.06 17.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.74 -50.33 65.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.83 -47.74 79.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.119 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 59.1 tp -56.81 -40.03 75.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -65.94 -32.73 74.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -55.0 37.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -67.78 -26.13 65.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.9 -33.95 36.93 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.491 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.86 36.17 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.462 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.76 43.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.766 0.317 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -73.27 -35.89 66.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.29 -37.44 85.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.96 -49.01 41.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.164 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -50.75 71.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.91 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.12 -42.22 85.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -53.95 -49.49 68.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.12 70.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.56 -49.91 17.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.26 79.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 59.3 m -64.21 -47.79 78.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.147 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -36.74 80.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.857 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -58.93 -43.8 91.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.34 -31.02 65.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -50.94 71.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 23.1 p -67.72 -50.41 57.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.113 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.59 -52.69 61.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 27.5 t -55.23 -35.84 65.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.848 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.87 -48.07 82.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -29.18 50.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.43 -21.55 63.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.111 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.497 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 1.8 mtpp -59.86 -62.54 5.69 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.615 0.722 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.71 -27.26 26.92 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 0.0 112.343 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.5 -31.85 57.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.121 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -72.8 -37.46 67.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.85 -51.33 63.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.78 61.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.97 -50.8 70.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.945 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.23 -37.48 85.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.829 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -56.52 -48.31 77.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.926 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.432 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.81 -28.39 73.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.508 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 23.3 tp -66.07 -33.33 75.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.83 0.348 . . . . 0.0 110.931 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.9 tp -49.98 -60.13 5.69 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 0.0 110.911 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.1 Cg_endo -69.77 -39.56 6.34 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.692 2.261 . . . . 0.0 112.345 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.35 -54.49 32.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.02 -34.88 73.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -64.85 -35.17 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.882 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.03 -48.54 79.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.85 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -40.76 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.862 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.21 -47.7 78.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.79 -40.17 69.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.153 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.64 -50.18 74.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -61.34 -38.65 87.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.885 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -35.28 79.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.896 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 8.8 m -69.9 -30.15 67.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.9 -50.96 45.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.11 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -42.05 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.0 -38.82 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.66 -47.3 63.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -54.07 -39.23 66.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.892 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 36.5 p -69.27 -45.63 69.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.149 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.41 -54.3 42.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.92 -36.3 81.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.877 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 9.5 mt -57.57 -40.94 80.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 9.3 tp -62.2 -55.42 28.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -33.29 75.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.887 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.909 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.09 -37.94 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 36.8 p -61.33 -20.94 63.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.108 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.08 -31.8 8.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.74 -29.9 42.45 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -51.17 -35.33 35.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 110.945 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -50.12 74.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.79 -40.95 96.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.02 -47.73 84.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -40.56 98.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -58.24 -50.52 73.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -45.47 93.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.882 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -48.27 77.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.896 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 8.0 mt -57.38 -51.6 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.86 -47.87 64.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -64.14 -36.08 82.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.44 -32.16 56.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.158 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 2.2 tmtt? -75.28 -55.27 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.73 70.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.135 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -78.85 -36.68 41.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -52.76 -50.59 41.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.573 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mt-30 -40.77 -66.75 0.35 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.533 0.682 . . . . 0.0 110.926 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.9 Cg_endo -69.78 -21.72 33.0 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.675 2.25 . . . . 0.0 112.349 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -52.89 -56.14 18.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.875 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 pp -61.19 -28.19 68.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -45.9 90.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.844 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -73.09 -38.0 66.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.09 -53.5 56.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.874 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -42.66 99.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.873 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -61.84 -26.99 68.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -72.79 -47.94 42.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -26.67 68.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.24 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.11 -35.52 77.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -71.22 -29.46 65.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -64.44 -50.67 66.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -64.19 -40.22 95.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.26 -24.76 57.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -65.18 -55.66 17.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -39.47 83.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -66.2 -24.95 66.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -92.24 -37.79 12.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.923 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.4 -31.86 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.516 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.4 mt-10 -61.85 -63.86 3.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 0.0 110.872 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.73 -50.39 0.47 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.276 . . . . 0.0 112.363 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -63.89 1.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.99 -30.16 1.67 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.5 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.31 -44.34 37.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.866 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -44.36 61.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.859 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -51.78 62.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -61.62 -42.04 98.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.68 -50.49 62.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -33.78 75.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.63 -50.75 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.074 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -55.98 -50.34 71.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.881 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.66 -30.87 70.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.109 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -67.92 -50.63 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.35 -39.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -54.66 -52.28 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.97 -48.27 74.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.062 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.76 -42.38 79.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -66.41 -39.18 88.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.79 -47.29 82.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.155 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -79.03 -35.35 42.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.829 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.9 tt -71.76 -15.93 62.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.887 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.488 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -60.65 -62.66 5.52 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.605 0.717 . . . . 0.0 111.122 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.75 -40.15 5.67 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 0.0 112.356 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -62.71 -34.32 76.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.892 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -61.35 -46.45 90.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.86 -48.16 81.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.44 -51.86 63.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 12.4 tp -60.08 -49.56 77.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -63.89 -34.29 77.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.76 -35.73 80.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.03 -50.82 25.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -51.58 58.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.25 -44.31 75.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.113 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.82 -35.05 69.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -65.25 -33.86 77.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.52 -50.53 20.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.925 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.32 -47.55 76.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -60.04 -48.74 80.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 57.9 tp -57.3 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -70.36 -33.7 71.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -54.16 47.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.846 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -67.95 -25.95 65.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.85 -33.87 36.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.516 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.03 -32.19 34.45 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.46 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.32 -25.51 42.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.327 . . . . 0.0 111.102 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 8.3 ttp180 -73.01 -36.81 67.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.897 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -37.26 83.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.935 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.91 -48.82 42.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.094 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -51.29 69.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -57.91 -42.48 84.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -53.52 -49.67 67.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.85 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.29 -31.05 70.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -75.51 -49.87 17.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.909 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.39 -35.44 79.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.118 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 56.5 m -64.02 -47.72 79.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -36.76 80.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.892 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -58.97 -43.57 91.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.51 -31.05 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -50.87 71.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 23.2 p -67.66 -50.41 57.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 26.7 tp -54.68 -52.65 61.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.882 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 27.7 t -55.25 -35.79 65.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.839 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.96 -48.04 82.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.87 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.18 50.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.58 -21.41 63.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 1.8 mtpp -59.98 -62.53 5.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.555 0.693 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.5 Cg_endo -69.78 -27.24 26.61 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.686 2.257 . . . . 0.0 112.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.58 -31.87 57.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -72.66 -37.5 67.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.94 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.88 -51.17 64.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.77 61.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.81 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -62.09 -50.85 70.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.15 -37.49 85.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.842 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -56.45 -48.37 77.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.427 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -68.76 -28.37 73.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.494 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 23.4 tp -66.12 -33.32 75.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.488 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.9 tp -50.07 -60.03 5.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.598 0.713 . . . . 0.0 110.918 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.9 Cg_endo -69.76 -39.63 6.28 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.662 2.241 . . . . 0.0 112.369 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.36 -54.51 31.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.161 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.01 -34.87 73.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -64.9 -35.11 80.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.09 -48.52 79.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.854 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -40.87 76.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.927 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.16 -47.75 78.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.902 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.74 -40.21 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.136 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.18 74.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -61.35 -38.6 87.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.38 -35.45 80.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 8.6 m -69.78 -30.22 67.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.86 45.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.122 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.28 -42.12 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -38.73 92.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.892 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.71 -47.26 63.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -54.17 -39.13 66.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.9 p -69.32 -45.63 69.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.135 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -54.47 -54.24 43.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.84 -36.35 82.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.931 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 9.4 mt -57.52 -40.89 79.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.881 0.372 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.5 -57.04 10.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.12 -33.79 58.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.63 -52.85 55.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -27.83 65.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.0 m -58.61 -26.9 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -50.87 -47.44 60.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.93 -29.26 19.52 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.514 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -49.83 -43.21 48.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 0.0 110.933 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.9 ttt180 -58.03 -49.42 76.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.79 88.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.897 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.26 -49.95 72.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -42.54 81.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.77 -50.5 73.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.838 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -43.56 89.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -48.49 78.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.2 tp -57.01 -49.87 74.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.28 -48.0 71.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.43 -35.98 82.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.39 -32.83 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.092 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -74.5 -52.63 11.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.76 -32.58 72.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -77.98 -33.57 51.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.98 -43.29 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.537 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.4 OUTLIER -43.95 -64.93 0.67 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.59 0.709 . . . . 0.0 110.911 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.69 -30.31 22.81 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 0.0 112.371 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -58.25 -27.44 63.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -50.71 28.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -33.79 76.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.48 -48.12 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.838 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -56.59 -52.57 64.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -45.7 84.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -62.9 -22.71 66.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -72.95 -47.73 42.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -30.0 70.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -56.23 15.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.97 -34.39 71.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -69.51 -34.41 74.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 23.5 ttp -68.84 -54.29 16.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -64.29 -35.78 81.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.67 -26.06 54.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -62.81 -55.35 27.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -35.14 62.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 tt0 -68.02 -23.95 65.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -85.82 -43.85 12.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.39 -32.47 48.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.55 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 mm-40 -56.54 -65.58 1.57 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.663 0.744 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.74 -52.3 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.637 2.224 . . . . 0.0 112.357 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.24 -65.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.27 -33.95 2.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -76.22 -44.77 36.14 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.88 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -66.86 -43.52 83.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -47.13 73.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -64.99 -42.34 94.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.84 -53.08 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.26 -38.53 83.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.862 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.75 -42.02 99.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -60.21 -53.26 59.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.01 50.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -56.95 -46.03 82.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 5.1 t -59.33 -52.5 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.172 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.36 -52.37 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.845 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.38 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.134 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.19 -44.26 87.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -67.54 -43.99 79.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 23.9 m -55.84 -42.1 75.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.171 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 -33.89 30.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.13 -23.19 62.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.484 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -55.49 -62.57 4.24 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.577 0.703 . . . . 0.0 111.043 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.484 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 54.0 Cg_endo -69.72 -43.13 2.87 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.709 2.273 . . . . 0.0 112.324 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -60.9 -28.99 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 12.7 t -59.67 -51.82 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.818 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.29 -48.93 68.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.65 -51.58 68.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.06 -46.57 90.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.875 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -42.96 81.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -34.46 78.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -49.76 57.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -50.58 45.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.58 64.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.34 -34.32 55.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.118 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -48.28 81.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.6 pp -68.83 -49.18 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -50.53 73.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.87 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.59 87.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.136 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 52.7 tp -67.75 -34.85 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -31.28 66.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.23 -55.73 27.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.96 -26.27 66.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.85 39.08 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.497 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.08 -33.89 38.21 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.53 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.06 -23.83 38.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -32.53 67.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.4 pp -63.14 -36.92 85.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.886 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.54 -49.53 32.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.13 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -44.89 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.856 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -60.4 -46.82 88.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.887 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -49.23 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.898 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.89 -31.69 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.46 -49.31 16.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.68 78.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.129 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.9 m -66.32 -47.61 72.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -69.9 -36.24 75.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.44 84.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.872 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 mp -71.23 -30.13 65.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 -51.33 69.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.836 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.66 -50.37 51.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.133 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.97 -54.92 32.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 43.2 m -54.62 -35.66 63.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.827 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.56 -48.35 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.09 -27.8 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.24 -22.01 64.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.501 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 9.9 mmtt -61.21 -63.07 4.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.567 0.699 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 54.6 Cg_endo -69.69 -26.92 27.43 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.717 2.278 . . . . 0.0 112.354 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.71 -32.88 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -36.65 73.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -54.32 -50.62 66.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.48 -30.49 63.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.14 -48.41 78.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -70.39 -41.97 72.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.7 -25.76 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.955 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.461 ' O ' ' HD2' ' A' ' 220' ' ' PRO . . . -79.04 -44.49 9.8 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.73 -27.54 68.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.501 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 2.7 mp -50.85 -62.97 2.18 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 0.0 110.892 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.0 Cg_endo -69.69 -44.63 2.01 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.755 2.304 . . . . 0.0 112.328 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 90.5 t -55.88 -54.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.85 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -66.37 -40.12 89.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -48.06 83.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.872 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.91 -38.06 82.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.78 -49.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.145 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -50.75 72.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.832 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.38 -37.98 82.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.2 -40.59 97.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.28 72.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.91 -44.93 68.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.27 -38.99 88.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.6 -35.4 62.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -68.05 -48.87 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -63.74 -41.01 98.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.97 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 37.9 p -70.75 -45.88 63.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -56.22 -55.07 37.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.83 79.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 30.8 mt -57.77 -37.72 74.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.908 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.891 0.376 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -57.01 10.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.06 -33.73 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.885 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.75 -52.85 54.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -27.8 65.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -58.6 -26.84 64.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -51.02 -47.67 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -29.26 18.86 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.528 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -49.95 -42.98 49.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -58.15 -49.47 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -44.77 88.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.908 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.21 -50.14 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.26 -42.28 81.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.856 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.88 -50.41 74.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -43.64 90.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.88 -48.87 77.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 39.1 tp -57.04 -49.49 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.955 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -54.31 -47.83 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -36.11 82.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.41 -32.7 59.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.099 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -75.09 -52.96 9.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.14 73.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -78.26 -33.83 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . 0.416 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.4 t -55.58 -47.53 78.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.139 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.558 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.4 OUTLIER -42.61 -66.23 0.45 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.619 0.723 . . . . 0.0 110.942 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.2 Cg_endo -69.77 -29.6 23.58 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.695 2.264 . . . . 0.0 112.303 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.5 t80 -58.0 -26.15 62.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.89 -49.43 17.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.932 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.15 -33.55 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.86 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -47.56 63.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -55.83 -52.94 62.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.887 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -47.28 79.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -60.37 -22.33 63.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -74.11 -48.47 29.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.871 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -31.92 73.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.6 -55.45 20.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.96 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -70.7 -34.57 72.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -69.79 -33.0 71.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 20.5 ttp -69.65 -54.4 14.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.64 -35.76 82.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -76.29 -25.98 55.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -62.92 -55.19 28.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -33.86 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.449 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 2.3 tt0 -69.37 -23.33 63.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -87.47 -44.99 10.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.9 -32.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.122 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.545 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mm-40 -57.16 -65.35 1.78 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.3 Cg_endo -69.86 -51.4 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.66 2.24 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -65.89 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.942 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.32 -34.17 1.53 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.504 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tp10 -77.14 -47.01 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 110.877 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.32 -47.69 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -51.46 63.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -60.04 -44.13 94.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.21 -52.22 50.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.95 -33.33 73.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.36 -46.42 83.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 9.7 ttp180 -58.9 -52.71 64.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.51 -54.88 42.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -57.9 -42.6 85.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 4.6 t -61.08 -51.47 72.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.27 -50.87 28.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.32 -44.65 87.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.093 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -57.93 -41.61 83.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 -67.89 -45.4 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 23.8 m -55.94 -41.23 74.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -81.54 -33.98 31.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.833 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.67 -23.38 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.483 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -55.52 -62.42 4.51 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.546 0.689 . . . . 0.0 111.123 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.3 Cg_endo -69.77 -41.29 4.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.679 2.253 . . . . 0.0 112.38 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -62.56 -29.34 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 7.7 t -59.62 -51.47 69.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.79 -49.11 69.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.95 -51.57 68.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.98 -46.68 89.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -42.62 81.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -34.65 78.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -48.8 63.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.875 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -50.59 40.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.947 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.22 -35.23 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.091 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.33 -34.31 55.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.103 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -48.28 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.904 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.6 pp -68.99 -48.86 62.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.72 -50.51 73.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.08 89.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 52.5 tp -67.68 -34.84 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -31.77 66.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -55.12 -55.59 29.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.77 -26.21 66.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.4 -33.67 40.19 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.01 -34.08 38.03 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.465 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.04 -23.79 38.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.733 0.301 . . . . 0.0 111.097 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -32.52 67.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.4 pp -63.08 -37.01 85.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.51 -49.57 31.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.053 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -44.59 90.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.62 -46.96 88.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.43 -49.22 67.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.61 70.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.078 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.49 -49.24 17.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.4 -34.89 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.1 m -65.95 -47.64 73.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.173 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -69.94 -36.23 75.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.885 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.37 84.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.33 -30.07 65.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.83 -51.24 69.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.856 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.75 -50.25 52.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.163 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.17 -54.94 32.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.869 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 43.3 m -54.53 -35.71 63.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.57 -48.31 81.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.07 -27.87 48.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.97 64.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.075 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 9.8 mmtt -61.28 -63.13 4.67 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.597 0.713 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.8 Cg_endo -69.82 -26.7 27.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.03 57.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.34 -36.48 74.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -54.34 -50.31 67.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -30.54 63.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.17 -48.32 79.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -70.42 -42.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.81 -25.59 68.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.449 ' O ' ' HD2' ' B' ' 220' ' ' PRO . . . -79.03 -44.62 9.68 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.456 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.64 -27.54 69.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.816 0.341 . . . . 0.0 110.93 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 2.6 mp -50.86 -62.92 2.23 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.593 0.711 . . . . 0.0 110.902 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.2 Cg_endo -69.81 -44.51 2.0 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.672 2.248 . . . . 0.0 112.323 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 90.3 t -55.94 -54.19 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.132 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.88 71.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.915 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -66.33 -40.08 89.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -48.05 83.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.847 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -40.19 93.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -38.07 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 53.2 t -56.71 -49.09 79.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -50.75 72.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -60.42 -37.93 82.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.24 -40.63 97.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.886 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -31.26 72.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.865 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.92 -44.98 68.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.2 -39.04 88.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.59 -35.51 62.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.96 -48.86 64.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.913 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -63.75 -41.09 98.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 38.0 p -70.69 -45.83 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.123 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -56.22 -55.06 37.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.81 79.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.74 -37.75 74.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.906 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.855 0.359 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.6 -56.43 22.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.58 -34.45 74.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.929 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -56.48 -51.61 67.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -72.14 -32.12 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.6 m -65.86 -23.69 66.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.135 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.04 -32.01 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.89 -27.85 14.84 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -49.15 -34.71 14.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.79 0.329 . . . . 0.0 110.897 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -61.81 -49.88 74.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.12 -43.79 95.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.69 -49.69 74.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.18 -41.55 84.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.918 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -50.1 74.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.881 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.72 -44.29 90.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.24 -47.7 77.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 37.1 tp -57.39 -50.29 73.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.872 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -47.87 69.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.881 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -64.12 -34.86 79.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 74.4 t -65.54 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -74.71 -52.88 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.833 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.72 -33.11 73.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.119 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -77.37 -33.25 55.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.0 t -58.48 -43.93 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.143 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -43.87 -65.03 0.64 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.586 0.708 . . . . 0.0 110.897 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.75 -31.29 20.84 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.669 2.246 . . . . 0.0 112.375 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -58.18 -25.54 61.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.19 -50.17 35.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.95 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -64.36 -34.87 79.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.91 -52.39 65.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -64.49 -43.89 92.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -64.38 -22.89 67.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -49.42 34.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -29.06 69.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -56.86 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.878 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -70.99 -34.43 71.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.892 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.01 -34.3 75.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -68.89 -54.03 17.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.82 -35.58 81.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.866 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.62 -26.65 55.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -62.13 -55.24 30.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -34.01 61.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.86 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 48.2 tt0 -68.17 -23.83 64.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmtt -86.73 -44.33 11.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 55.6 t -59.0 -32.65 48.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.1 mt-10 -56.91 -65.62 1.61 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.666 0.746 . . . . 0.0 110.896 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.1 Cg_endo -69.79 -52.19 0.34 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 0.0 112.302 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.66 -64.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.19 -32.39 2.51 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.514 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -44.85 34.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.868 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -68.06 -41.91 81.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -46.25 74.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.894 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -66.49 -41.59 88.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.73 -52.86 18.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -59.54 -39.87 85.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.77 -41.15 99.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.139 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -52.63 64.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.21 45.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.123 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -56.29 -45.32 80.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.72 -52.17 64.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.088 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.03 -52.35 15.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.881 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.2 93.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.103 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.01 -44.23 87.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.3 -44.59 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 24.3 m -55.58 -42.11 74.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.125 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -81.86 -32.61 31.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.799 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -69.98 -24.51 63.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.929 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.484 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -54.38 -62.94 3.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.484 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.4 Cg_endo -69.78 -43.36 2.69 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.692 2.261 . . . . 0.0 112.348 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.4 -33.4 69.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.876 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -52.11 64.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -67.06 -31.95 72.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.881 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -66.79 -51.15 59.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.46 -49.76 76.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -36.31 72.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.853 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.82 -52.63 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.53 -47.74 77.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.84 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.1 -51.43 69.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.61 -35.79 63.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.083 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.27 50.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.066 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -48.32 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.868 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.42 -49.71 62.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -59.71 -34.09 72.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.27 -45.3 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.081 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.57 -40.97 76.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -75.61 -32.2 60.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -56.82 15.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.844 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.75 -26.33 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.905 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.29 -34.39 40.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.53 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.67 38.77 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.1 39.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.78 0.324 . . . . 0.0 111.08 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -73.56 -32.49 64.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.872 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -37.91 89.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.2 -49.92 31.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.087 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -63.87 -42.1 97.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.1 -45.27 92.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -54.47 -47.9 72.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.829 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.65 72.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -76.04 -50.6 14.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.34 93.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.119 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 83.6 m -61.43 -47.48 85.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -36.51 83.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.853 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.57 -44.66 89.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.842 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -71.85 -30.09 65.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.6 m -57.44 -51.37 69.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -51.06 50.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.197 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.33 -54.84 34.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 50.7 m -54.53 -35.23 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.09 -47.8 83.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -77.71 -30.28 51.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.22 -22.13 64.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.126 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.514 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -59.14 -63.37 4.26 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 110.904 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.514 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.75 -24.73 29.4 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.722 2.282 . . . . 0.0 112.348 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.2 -32.5 59.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.092 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.12 -35.88 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -53.85 -51.6 63.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.15 -30.85 58.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.9 tt -61.89 -51.26 68.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.949 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.48 -37.13 84.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -56.74 -48.87 76.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.877 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.416 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -67.53 -29.53 74.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.478 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.24 -32.96 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.348 . . . . 0.0 110.921 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -49.81 -61.14 3.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.644 0.735 . . . . 0.0 110.912 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.76 -39.61 6.31 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.663 2.242 . . . . 0.0 112.363 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.0 -54.73 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.21 74.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -65.85 -35.34 80.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 14.1 m -59.88 -48.19 82.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -43.1 94.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 51.6 t -55.76 -43.56 74.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.2 -50.45 73.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -61.09 -38.98 88.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.19 -33.39 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -31.43 67.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.795 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.44 -53.05 39.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.119 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.18 -43.3 87.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.941 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.3 -34.65 78.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.55 -49.34 75.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.23 -45.83 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.907 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.36 -45.95 88.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.15 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.11 -53.89 50.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -45.88 77.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 13.1 tp -56.91 -37.42 71.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.842 179.883 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.3 t30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.876 0.37 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.45 -56.4 22.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.8 -34.31 74.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -56.41 -51.54 67.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -72.23 -32.33 66.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.5 m -65.58 -23.54 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.153 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.22 -32.14 15.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -27.98 14.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.435 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -49.09 -34.61 14.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.314 . . . . 0.0 110.892 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -61.85 -49.96 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.854 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.16 -43.75 95.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.67 -49.62 74.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.41 -41.34 84.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.75 -44.37 90.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.1 -47.91 77.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.54 -49.88 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.924 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.46 -47.58 69.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -64.52 -34.93 79.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 71.0 t -65.52 -32.9 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.129 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -75.36 -53.3 8.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.78 74.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.117 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -77.45 -33.43 54.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . 0.412 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.3 t -55.31 -47.75 77.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.14 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.565 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -42.28 -66.49 0.41 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.609 0.719 . . . . 0.0 110.91 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.565 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.74 -30.45 22.37 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . 0.412 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.8 t80 -57.5 -25.04 59.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.907 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.42 -49.4 19.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -59.68 -34.7 73.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.874 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -47.49 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -55.99 -52.57 63.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.46 -44.62 90.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -62.71 -22.5 66.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -50.28 22.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.906 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.42 -30.58 71.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -56.44 13.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.42 -34.88 73.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -69.14 -32.52 71.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.913 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -69.8 -54.01 15.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -65.6 -35.43 80.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.18 -26.63 56.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.51 -55.07 30.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.957 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -33.36 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 48.8 tt0 -69.12 -22.78 63.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -88.39 -46.39 9.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 56.4 t -58.72 -32.59 46.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 1.0 OUTLIER -57.5 -65.53 1.74 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.616 0.722 . . . . 0.0 110.871 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.69 -51.66 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.685 2.257 . . . . 0.0 112.338 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -65.37 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.78 -32.0 2.03 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.27 -46.79 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.43 -46.34 73.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -51.96 61.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -60.32 -43.14 96.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.883 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.49 -52.01 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -59.97 -34.07 72.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.27 87.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.115 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.852 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.25 -54.94 39.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.075 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -56.76 -43.87 81.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.862 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.21 -51.34 74.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.48 -51.49 20.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.8 90.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.115 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.08 -42.24 85.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.912 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.55 -45.63 75.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 24.2 m -55.61 -41.52 73.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.145 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -81.51 -32.89 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.25 -24.6 63.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.485 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -54.23 -62.75 3.46 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.605 0.717 . . . . 0.0 111.089 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.7 Cg_endo -69.75 -42.37 3.47 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 0.0 112.346 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -59.57 -33.68 71.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.43 -52.0 65.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -66.76 -32.34 73.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.8 -51.0 60.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -49.57 76.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -36.13 72.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -52.43 62.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.891 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.16 -47.72 78.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.861 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.41 -51.22 70.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.903 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.82 -35.45 63.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.12 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.34 50.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -47.94 60.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.85 -49.55 61.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.57 -34.21 72.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.31 -45.39 47.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.068 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.84 -40.93 76.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -75.64 -32.85 60.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.899 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -56.53 18.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.67 -26.31 60.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.855 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.45 -34.22 41.67 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.457 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.13 -33.71 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.529 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.11 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -73.54 -32.74 64.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -38.15 90.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.15 -49.71 33.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.124 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.97 -41.83 97.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.29 -45.46 91.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.33 -47.75 72.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.881 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.35 -31.55 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.084 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -76.03 -50.52 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.63 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.126 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 80.9 m -61.27 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.166 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -36.51 83.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.6 -44.55 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.01 -30.13 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 9.2 m -57.45 -51.24 70.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.835 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -51.02 50.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.137 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.44 -54.84 35.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.875 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 50.3 m -54.69 -35.09 63.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.1 -47.77 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -77.81 -30.4 51.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.883 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.19 -22.1 64.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.127 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.519 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -59.15 -63.48 4.12 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.556 0.693 . . . . 0.0 110.911 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.9 Cg_endo -69.81 -24.71 29.12 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.332 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.29 -32.29 58.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -73.19 -35.78 66.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -53.78 -51.45 63.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.914 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.16 -30.78 58.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.9 tt -61.95 -51.36 68.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.955 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.35 -37.12 84.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -56.76 -48.8 77.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.408 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -67.55 -29.41 73.98 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.5 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.27 -32.98 74.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.897 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.0 OUTLIER -49.79 -61.13 3.91 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.62 0.724 . . . . 0.0 110.931 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.73 -39.71 6.24 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.707 2.271 . . . . 0.0 112.349 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.06 -54.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.113 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.17 74.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -65.85 -35.37 80.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 14.0 m -59.86 -48.18 82.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.3 -41.94 96.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -43.15 94.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.68 -43.49 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.152 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.34 -50.33 74.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -61.13 -39.01 88.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.854 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.18 -33.4 74.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.57 -31.34 66.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.06 39.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.143 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.13 -43.23 87.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.917 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.34 -34.62 78.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.65 -49.25 75.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.18 -45.96 86.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.953 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.27 -45.97 88.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.119 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.17 -53.84 50.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -45.91 77.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 13.1 tp -56.77 -37.52 71.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.943 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -45.51 64.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.55 65.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.58 -32.04 65.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.14 -48.53 78.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.37 -45.48 31.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.124 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.57 -30.84 67.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.931 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.42 56.09 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.7 mt -58.89 -35.8 73.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -49.62 77.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -68.6 -48.21 64.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.12 -29.19 69.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.855 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.56 -51.81 13.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.0 p -65.66 -35.88 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -40.63 64.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -61.96 -48.09 81.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.67 -50.94 55.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -58.01 -42.47 85.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.89 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.45 -47.94 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.898 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.72 -33.16 39.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.114 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -52.32 10.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.87 -35.61 77.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -79.27 -34.92 42.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.417 ' HA ' ' HB2' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -53.51 -44.77 57.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.112 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.56 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -47.67 -65.96 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.58 0.705 . . . . 0.0 110.92 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.56 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.6 Cg_endo -69.71 -24.87 29.42 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.668 2.245 . . . . 0.0 112.347 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.417 ' HB2' ' HA ' ' A' ' 97' ' ' VAL . 2.7 m-30 -61.35 -35.08 76.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -51.66 16.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.943 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.05 -34.27 77.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.62 -47.32 76.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.41 -52.05 67.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -64.73 -47.52 77.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -63.99 -22.68 67.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.908 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -71.11 -48.52 51.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -23.31 57.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -64.99 -60.02 3.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.66 -34.32 73.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.42 -30.51 69.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -71.8 -53.28 13.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.87 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.29 -35.02 79.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.35 -26.19 55.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.65 -54.76 23.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.951 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.87 -33.9 66.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.417 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 22.1 tt0 -70.19 -23.09 62.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -90.3 -45.22 9.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 94.5 t -59.98 -32.45 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.139 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.539 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -57.88 -64.68 2.45 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.637 0.732 . . . . 0.0 110.901 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.4 Cg_endo -69.8 -50.94 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.679 2.253 . . . . 0.0 112.32 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -63.54 1.04 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.5 -30.47 4.49 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.496 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.52 -43.32 56.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.328 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.19 -33.96 63.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 2.6 ttt -66.99 -48.94 66.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -38.26 86.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.872 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -71.57 -52.58 17.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.8 mmt-85 -63.0 -38.2 90.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.69 88.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -64.04 -49.89 70.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.6 -38.67 70.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.043 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -66.9 -50.74 61.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . 0.418 ' CG1' ' N ' ' A' ' 157' ' ' ASP . 4.8 p -64.32 -40.62 89.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.418 ' N ' ' CG1' ' A' ' 156' ' ' VAL . 22.4 t0 -52.61 -50.56 62.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.833 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.48 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.099 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.96 -38.73 73.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -68.51 -45.57 71.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.839 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 34.7 m -55.4 -40.98 72.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.77 -34.04 30.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.02 -21.47 62.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.489 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -56.44 -62.66 4.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.61 0.719 . . . . 0.0 111.098 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.489 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.9 Cg_endo -69.74 -42.23 3.61 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.335 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -55.76 -33.68 64.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -51.58 69.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.834 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.73 -32.69 73.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.864 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -50.05 72.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.59 77.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.69 -37.74 76.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.62 -51.79 68.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.44 -38.69 81.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -41.92 75.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -45.45 75.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.25 -34.57 70.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.078 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.86 -37.5 87.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.09 -51.6 44.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -65.93 -40.64 91.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.77 -46.48 77.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -35.88 79.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.898 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -31.84 69.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.888 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -56.15 21.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.865 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.8 -25.76 63.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.53 -31.72 44.67 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.511 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -64.02 -49.88 64.35 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.46 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.68 -21.83 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.322 . . . . 0.0 111.127 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -71.76 -29.11 64.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -49.91 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.914 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.45 -48.95 68.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.115 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -63.37 -51.45 65.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.903 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -54.11 -48.93 70.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.91 69.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.68 -42.4 41.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.922 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.94 -47.7 73.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.137 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 40.0 p -60.07 -46.82 88.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.187 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.88 -35.86 75.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.12 -54.27 46.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -28.7 64.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.53 -51.41 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.817 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -50.85 30.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.71 -57.34 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -54.46 -35.96 63.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.99 -47.84 81.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -27.75 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.31 66.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.524 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.0 OUTLIER -64.61 -63.99 3.17 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.581 0.705 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.524 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.4 Cg_endo -69.77 -26.85 27.13 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.724 2.283 . . . . 0.0 112.298 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.73 -31.75 59.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 5.7 tt -71.2 -40.83 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.65 -51.16 66.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -75.99 -29.81 58.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.851 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -45.78 91.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -72.92 -40.03 65.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -68.06 -25.12 65.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.471 ' O ' ' HD2' ' A' ' 220' ' ' PRO . . . -80.7 -49.84 5.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -27.99 69.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.846 0.355 . . . . 0.0 110.925 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.515 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -50.51 -63.43 1.85 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.596 0.712 . . . . 0.0 110.948 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.2 Cg_endo -69.74 -46.44 1.23 Allowed 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.709 2.272 . . . . 0.0 112.363 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 94.0 t -54.59 -55.09 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.187 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.06 -31.71 70.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.937 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -69.11 -36.28 77.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.58 83.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.22 -44.22 97.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -40.25 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 38.9 t -55.38 -48.39 76.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.102 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 2.3 t -59.02 -50.11 75.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.831 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.09 -35.22 79.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.859 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.09 -34.24 77.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.908 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 67.4 m -73.56 -31.4 63.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.55 57.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.113 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.7 pp -64.9 -37.93 89.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.5 -34.97 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.36 -49.9 57.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -58.93 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.905 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 35.1 m -67.88 -39.81 83.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.145 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.63 -54.17 49.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -48.99 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.945 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.06 -33.47 69.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 179.943 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.88 0.372 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.02 -45.42 63.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.0 -33.58 65.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.48 -32.13 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.1 -48.56 78.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -45.49 31.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.118 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.55 -30.98 67.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.878 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.38 -33.49 56.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.85 -35.78 73.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.794 0.331 . . . . 0.0 110.9 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -49.73 76.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -68.49 -48.0 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.34 -29.1 69.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.53 -51.6 14.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.912 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 19.1 p -65.93 -35.9 81.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.862 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -40.61 64.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.15 -48.58 79.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.3 -50.75 59.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -57.78 -42.79 84.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.88 -45.05 60.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 4.0 t -59.59 -33.93 53.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.134 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -53.91 7.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.87 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.124 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.8 tptt -79.14 -35.89 41.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.898 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -50.69 -47.64 28.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.113 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.595 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -45.73 -68.07 0.33 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.576 0.703 . . . . 0.0 110.941 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.4 Cg_endo -69.74 -18.11 37.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.696 2.264 . . . . 0.0 112.35 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -66.18 -34.36 77.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.96 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -50.81 11.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.49 -35.52 74.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.93 -46.84 73.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -52.24 66.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.44 -47.93 74.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -62.52 -22.51 66.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -72.31 -48.42 42.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -24.98 59.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.888 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.17 -60.8 2.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.47 -34.59 77.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -69.19 -30.43 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.885 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -70.37 -53.67 15.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -66.68 -35.03 79.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.06 -26.21 56.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.888 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -65.56 -54.94 20.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -73.12 -33.56 65.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.427 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 22.6 tt0 -70.45 -22.56 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.927 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -91.13 -45.61 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.26 -32.77 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.155 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -58.04 -64.54 2.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.644 0.735 . . . . 0.0 110.892 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.1 Cg_endo -69.76 -50.29 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.685 2.257 . . . . 0.0 112.319 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -64.09 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.876 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.43 3.74 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.493 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -75.37 -45.39 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.822 0.344 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.72 -35.93 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 1.8 ttt -66.66 -54.04 27.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.877 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -39.3 93.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -68.83 -52.68 27.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 7.4 mmt-85 -63.63 -32.26 73.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.31 -42.89 92.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.082 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -62.18 -46.54 88.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.22 69.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.08 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -66.76 -50.67 61.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.8 p -63.49 -40.02 87.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.168 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -52.84 -50.32 63.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.73 -48.96 67.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.145 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.39 -38.07 73.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 20.7 tpp85 -68.61 -45.15 72.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 34.8 m -55.8 -40.83 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.94 -34.07 29.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.836 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.33 -21.63 62.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.483 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -56.15 -62.39 4.85 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 0.0 111.092 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.1 Cg_endo -69.71 -41.56 4.23 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.724 2.282 . . . . 0.0 112.367 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.51 -34.22 66.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.955 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.15 -51.45 69.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.69 -32.91 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -50.06 71.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.9 -37.96 77.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -51.66 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.937 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -39.34 81.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.867 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -41.59 77.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.15 75.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.87 71.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.77 -36.97 86.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.817 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.59 -51.37 43.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.897 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.45 -42.19 92.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.945 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.19 77.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.084 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -35.35 77.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -31.51 70.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.952 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -55.85 24.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.81 -25.82 63.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.54 -31.97 45.17 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.464 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -63.83 -49.9 64.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.495 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.86 -21.65 43.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.071 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -71.89 -29.11 64.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -49.9 75.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.39 -49.02 68.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.114 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.22 -34.2 76.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.867 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.2 -51.56 65.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.917 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -54.02 -48.8 70.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.835 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.82 69.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.123 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.73 -42.34 41.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.71 73.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 39.9 p -60.12 -46.82 88.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.084 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.87 -35.83 75.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.21 -54.32 45.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.821 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.07 -28.71 64.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.54 -51.27 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.81 30.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.117 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.84 -57.28 11.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.5 m -54.43 -35.98 63.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.97 -47.81 81.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.81 -27.78 44.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.46 -23.35 66.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.151 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.523 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.0 OUTLIER -64.47 -64.01 3.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.574 0.702 . . . . 0.0 110.923 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -26.89 27.36 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 0.0 112.331 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.68 -31.69 59.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.099 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 5.6 tt -71.13 -40.97 71.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.57 -51.12 66.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.903 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.94 -29.87 58.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.02 -45.69 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.91 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -73.01 -39.83 65.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.23 -25.07 65.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.474 ' O ' ' HD2' ' B' ' 220' ' ' PRO . . . -80.69 -49.94 5.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.472 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -28.01 69.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.866 0.365 . . . . 0.0 110.896 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.513 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.4 mp -50.45 -63.44 1.84 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.615 0.721 . . . . 0.0 110.921 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.82 -46.51 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.662 2.242 . . . . 0.0 112.338 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 91.9 t -54.56 -55.08 17.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.124 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.08 -31.79 70.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.896 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -69.1 -36.17 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -47.65 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.24 -44.18 97.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.864 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -40.33 95.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.39 -48.34 77.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.085 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 2.2 t -59.07 -50.06 75.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -35.33 79.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.1 -34.14 77.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 67.3 m -73.62 -31.41 63.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.57 56.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.077 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.7 pp -64.92 -37.95 89.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.41 -34.93 68.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.92 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.38 -50.01 56.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -58.87 -47.1 86.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.3 m -67.9 -39.86 83.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.61 -54.18 48.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -48.98 77.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 58.9 tp -58.08 -33.52 69.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.889 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.873 179.948 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.838 0.352 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.82 -54.91 39.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.58 -36.09 77.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -50.73 70.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.06 -31.44 61.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -22.07 60.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.149 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.58 -34.18 17.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.84 -27.04 19.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.476 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.36 -35.65 12.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.789 0.328 . . . . 0.0 110.93 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -60.27 -50.21 74.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -45.08 96.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -49.06 73.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.13 -40.78 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -50.66 73.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.78 -46.27 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -55.6 -46.15 77.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -57.48 -50.24 73.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -48.58 69.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.21 -36.68 84.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 70.5 t -64.99 -32.03 56.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -73.92 -52.64 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.85 -33.66 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.103 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -77.89 -32.85 52.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.0 t -58.35 -43.59 86.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.178 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 mm-40 -43.59 -65.21 0.61 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.701 . . . . 0.0 110.866 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.74 -32.15 19.24 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.712 2.274 . . . . 0.0 112.306 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -58.58 -25.02 62.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.929 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.58 -51.07 25.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -33.0 74.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.872 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -47.54 68.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.825 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.91 -52.46 64.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -64.58 -47.27 79.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.914 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -60.31 -22.96 63.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -74.71 -46.87 34.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.942 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -29.79 70.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -68.64 -54.61 15.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.896 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -35.12 73.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.849 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -70.41 -30.48 67.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -71.43 -53.26 14.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.916 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.36 -35.03 79.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.8 tp -76.15 -26.12 55.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.48 -54.18 26.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -72.96 -34.05 66.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 43.1 tt0 -70.34 -23.79 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.93 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -89.04 -45.05 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.87 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 99.5 t -61.33 -32.12 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.538 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.3 OUTLIER -56.22 -64.69 2.1 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.626 0.727 . . . . 0.0 110.845 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.5 Cg_endo -69.76 -52.02 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.693 2.262 . . . . 0.0 112.326 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -63.02 1.2 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.57 -32.38 2.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.458 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.31 -44.09 47.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.354 . . . . 0.0 110.927 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.56 -36.86 73.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -48.33 66.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.916 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -68.82 -37.75 79.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.2 -52.86 16.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -62.42 -41.37 98.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.64 -39.87 92.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.092 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -62.23 -53.12 59.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.12 61.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -60.58 -45.16 94.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.83 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.11 -53.72 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.37 -52.64 20.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.4 96.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.54 -41.89 86.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.941 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -65.54 -48.26 73.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 21.3 m -55.56 -42.46 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.129 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.88 -32.44 51.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.15 -19.63 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.472 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -59.68 -62.38 6.0 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.607 0.718 . . . . 0.0 111.121 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.1 Cg_endo -69.86 -47.12 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 0.0 112.327 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -55.92 -27.44 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -51.35 64.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.846 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.32 -34.51 78.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -51.96 21.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.932 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 8.8 mp -61.14 -49.45 77.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.913 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -61.22 -33.71 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -52.33 64.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.61 -43.1 69.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.97 -50.63 72.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.76 -32.81 74.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.25 -42.02 60.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.068 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -73.77 -32.09 63.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.69 -49.54 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.948 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.23 -35.59 71.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.02 -47.89 60.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.16 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.55 -43.32 93.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -32.43 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -51.03 68.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.92 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -69.08 -26.32 64.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.56 42.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.453 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.43 -31.9 36.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.462 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.47 -25.62 41.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -38.23 64.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -37.26 80.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.957 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.24 -48.78 40.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -47.99 81.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.29 -44.04 95.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.896 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.08 -47.44 71.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.861 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.49 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -76.07 -51.31 12.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.845 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.63 -45.66 78.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 95.3 m -59.59 -46.86 87.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.66 -38.65 91.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.59 -40.62 83.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.865 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -32.08 65.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.891 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.79 -50.99 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.854 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.29 -51.27 59.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.186 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.77 -50.23 68.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.82 -35.23 68.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.72 -47.81 84.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -31.75 56.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.34 63.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.085 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.5 OUTLIER -60.41 -63.12 4.66 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.601 0.715 . . . . 0.0 110.916 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.73 -27.65 26.37 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.68 2.254 . . . . 0.0 112.364 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.41 -31.82 58.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.29 -36.39 68.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.84 -50.91 65.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -73.68 -34.0 64.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.6 tt -61.46 -49.29 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.93 -36.1 83.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -57.03 -48.79 77.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.412 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -67.6 -29.52 74.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.438 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.19 -32.51 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.921 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.46 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.4 OUTLIER -49.42 -60.79 4.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.602 0.715 . . . . 0.0 110.947 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.82 -39.01 6.89 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.679 2.253 . . . . 0.0 112.333 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.17 -55.33 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 -34.42 73.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.58 -34.78 78.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -48.32 82.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.17 -42.5 79.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -63.08 -46.58 86.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 40.1 t -56.89 -39.91 68.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.129 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 28.7 m -58.67 -50.26 74.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -61.25 -36.76 80.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.912 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.71 -34.39 77.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -30.82 66.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.31 -51.37 53.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.111 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.56 -44.79 77.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.867 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -35.81 79.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.13 -48.9 66.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -54.16 -40.72 67.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.1 m -73.09 -40.23 65.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.097 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.54 -54.83 39.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -37.41 78.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.68 -38.16 74.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 179.921 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.888 0.375 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.65 -54.92 39.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.75 -35.97 77.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.46 -50.69 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.887 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.12 -31.4 61.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.92 -22.07 59.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.145 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.7 -34.25 18.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.89 -27.09 20.0 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.46 -35.58 13.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 0.0 110.903 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 64.6 ttt-85 -60.3 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -45.04 96.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.89 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.08 73.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.27 -40.62 86.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.94 -50.62 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.95 -46.43 88.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -55.38 -46.4 76.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 60.6 mt -57.46 -50.1 74.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -48.62 69.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.41 -36.58 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.901 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.12 -32.07 56.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.16 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -74.38 -53.07 10.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.921 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.0 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -78.22 -33.05 50.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . 0.418 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.4 t -55.13 -46.79 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.568 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.6 mm-40 -42.75 -66.52 0.42 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.663 0.744 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.568 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.78 -31.54 20.24 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.698 2.265 . . . . 0.0 112.305 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . 0.418 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 12.7 t80 -58.17 -24.19 58.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.52 -50.02 16.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.914 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -33.04 70.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.86 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -46.76 65.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -53.42 56.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -63.51 -47.72 80.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.937 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -61.06 -22.21 64.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -72.74 -48.08 41.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -63.4 -31.41 72.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.8 -55.82 20.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.1 -34.44 71.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.39 -32.75 70.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -53.45 18.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.4 -35.84 82.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.908 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -76.22 -25.96 55.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.877 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.68 -54.62 25.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -73.47 -33.59 64.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.867 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.421 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 44.0 tt0 -70.36 -23.05 62.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -90.83 -45.17 8.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.905 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 87.6 t -60.8 -32.46 52.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.532 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.2 OUTLIER -58.15 -64.47 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.648 0.737 . . . . 0.0 110.864 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.532 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 54.2 Cg_endo -69.75 -50.41 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.712 2.275 . . . . 0.0 112.362 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -64.74 0.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.65 -31.96 2.75 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.496 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.1 -46.06 30.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.877 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.15 -41.0 77.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -52.21 58.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -64.43 -37.36 87.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.847 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.55 -51.81 46.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -64.59 -35.19 80.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.63 88.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.065 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -60.04 -52.53 64.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -55.5 -54.54 42.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -61.52 -40.47 94.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.03 -52.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -51.26 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.26 -45.61 93.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.073 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -40.21 81.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.937 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -66.15 -47.83 72.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 21.4 m -56.14 -42.64 77.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.132 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.37 -32.84 55.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.48 -19.22 62.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.47 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -60.02 -62.08 6.61 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.535 0.683 . . . . 0.0 111.043 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.5 Cg_endo -69.81 -46.52 1.18 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.669 2.246 . . . . 0.0 112.312 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -56.68 -27.79 59.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.1 66.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.815 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -52.03 20.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 8.9 mp -61.04 -49.17 78.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -61.46 -33.72 74.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.874 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.66 -52.16 65.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.892 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.16 -43.57 70.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.4 tp -60.82 -50.46 73.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.9 -32.87 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.97 60.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.101 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -73.84 -31.95 63.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.867 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.48 -48.74 66.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.11 -38.88 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -67.03 -46.96 72.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -60.85 -42.18 97.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.926 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -33.07 67.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -50.54 69.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -69.09 -26.39 64.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.43 -34.55 42.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.9 36.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.35 -25.76 42.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.809 0.338 . . . . 0.0 111.11 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -38.31 64.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -37.27 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.16 -48.79 40.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -47.74 82.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.49 -43.96 96.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.947 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.13 -47.51 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.841 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.15 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -76.01 -51.25 12.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.73 -45.7 77.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.071 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 94.9 m -59.58 -46.79 87.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.132 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -63.75 -38.6 91.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.848 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -58.62 -40.66 83.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.94 -32.0 64.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -50.97 71.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.34 -51.24 59.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.184 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.82 -50.2 69.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.89 -35.26 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.65 -47.84 84.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -31.86 56.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.24 63.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.12 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.5 OUTLIER -60.55 -63.18 4.6 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 0.0 110.892 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -27.74 26.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.676 2.251 . . . . 0.0 112.365 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.37 -31.77 58.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.088 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.21 -36.28 69.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.81 -50.86 65.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.53 -34.2 65.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.824 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.38 -49.36 77.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.78 -36.16 83.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.84 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -57.03 -48.82 77.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.916 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.411 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -67.54 -29.46 74.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.508 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.25 -32.56 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.331 . . . . 0.0 110.883 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.469 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.4 OUTLIER -49.38 -60.86 4.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.597 0.713 . . . . 0.0 110.927 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 54.1 Cg_endo -69.69 -39.08 7.09 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.717 2.278 . . . . 0.0 112.383 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.21 -55.31 23.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.136 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -34.38 73.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.63 -34.74 78.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -48.34 82.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.866 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.13 -42.62 79.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.08 -46.53 86.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 39.8 t -56.88 -39.92 68.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.142 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 28.5 m -58.73 -50.21 74.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.874 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.26 -36.77 80.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.72 -34.31 77.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.55 -30.78 66.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.28 53.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.073 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.61 -44.75 77.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -35.73 79.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -67.2 -48.91 66.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.838 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -54.22 -40.7 67.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 96.9 m -73.07 -40.24 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.153 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.61 -54.75 40.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.903 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.06 -37.35 78.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 2.2 tp -57.58 -38.24 74.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.869 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.919 179.954 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.873 0.368 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -56.5 21.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.918 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.06 -34.9 72.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -56.59 -51.33 69.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -32.07 65.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.21 -24.75 67.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.158 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -50.91 -33.13 22.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.03 -26.84 9.24 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.508 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -47.4 -40.7 18.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -59.44 -49.83 76.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.12 -47.39 85.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.75 -49.69 67.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -40.37 82.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -59.88 -50.78 72.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.7 -46.21 87.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -55.47 -47.66 75.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.83 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -48.1 80.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.55 -47.57 76.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -36.58 83.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.58 -31.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.162 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -52.75 10.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.83 -33.71 75.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -77.35 -33.51 55.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 1.4 t -59.5 -42.15 87.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.103 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.536 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.1 OUTLIER -44.92 -64.73 0.78 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.611 0.72 . . . . 0.0 110.918 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.78 -31.52 20.25 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.679 2.253 . . . . 0.0 112.34 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.402 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 16.4 t80 -60.78 -24.88 66.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.937 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.23 -50.8 24.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.945 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -65.66 -34.24 77.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.858 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -47.32 77.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -52.26 66.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.84 -46.9 82.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.25 -22.58 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.902 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -71.46 -45.54 62.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.887 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -25.67 61.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.936 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -65.47 -59.53 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -67.83 -34.31 76.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.2 -31.46 68.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.916 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -68.41 -54.11 19.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.87 -34.74 78.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.929 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.74 -26.19 54.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.94 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -64.35 -54.57 30.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -33.28 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -71.34 -24.92 62.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -87.18 -47.07 9.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.89 -31.27 49.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.158 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.537 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 3.7 mt-10 -54.74 -64.7 1.77 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.583 0.706 . . . . 0.0 110.838 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.7 Cg_endo -69.77 -54.96 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.41 -62.48 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.01 -31.52 4.32 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.83 -42.77 57.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.796 0.331 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.19 -35.26 66.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 16.6 mtp -67.1 -48.92 66.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -37.54 79.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.841 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -71.0 -52.05 21.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -63.28 -35.65 81.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.935 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.77 -41.25 96.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.063 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -62.76 -47.97 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.08 -32.57 67.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -69.67 -50.43 44.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.26 -41.2 88.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.127 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -53.39 -52.86 57.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.37 -48.36 75.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.2 -38.55 73.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -44.08 78.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.61 -42.99 79.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -80.95 -29.77 35.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 34.8 tp -70.69 -18.2 62.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' ALA . . . . . 0.488 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -59.95 -63.11 4.63 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.572 0.701 . . . . 0.0 111.106 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 54.3 Cg_endo -69.71 -44.88 1.85 Allowed 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.722 2.281 . . . . 0.0 112.356 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.907 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.6 -49.18 72.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.17 -46.66 87.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.3 -52.33 54.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 17.8 tp -58.59 -47.69 83.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 8.7 mmp_? -56.56 -38.31 71.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.929 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.62 -49.14 77.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -61.03 -47.72 85.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.917 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.92 -46.01 89.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -36.22 65.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.22 -34.7 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -33.6 76.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 8.9 tt -73.61 -49.39 26.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -50.3 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.68 73.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.108 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.02 -35.83 79.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -65.25 -27.8 68.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.4 -56.6 15.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.58 -48.36 77.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -56.05 -32.28 59.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.493 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.46 71.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.25 -54.24 7.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 0.0 111.121 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -55.75 -28.62 56.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 11.4 tp -56.09 -47.32 78.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.56 58.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.08 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -60.32 -34.16 73.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.51 -47.25 79.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.91 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.51 -47.63 72.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.55 -30.71 71.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.12 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -49.67 20.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.34 87.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.116 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.02 -47.03 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.72 -39.49 91.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.85 -38.03 77.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -34.17 65.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.948 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.4 m -57.15 -50.74 71.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.37 -51.43 60.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.143 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.53 -47.76 72.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.914 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 24.6 p -59.33 -33.71 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.801 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.57 -46.97 88.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.56 -32.26 58.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.6 -20.35 63.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' LYS . . . . . 0.498 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -59.85 -62.82 5.12 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.593 0.711 . . . . 0.0 110.929 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.77 -27.34 26.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.693 2.262 . . . . 0.0 112.352 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.62 -35.59 60.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.126 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.75 -34.87 74.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.954 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -51.05 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -71.25 -34.65 70.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.88 -50.34 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -36.35 83.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -56.81 -48.56 77.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.954 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' GLY . . . . . 0.418 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -66.64 -29.26 74.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.51 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.03 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.6 OUTLIER -48.77 -60.73 4.13 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.627 0.727 . . . . 0.0 110.938 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' PRO . . . . . 0.466 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.9 Cg_endo -69.75 -38.56 7.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.68 2.253 . . . . 0.0 112.367 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.17 -54.22 35.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -35.0 74.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.91 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.49 -37.29 86.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' SER . . . . . 0.418 ' O ' HG23 ' A' ' 227' ' ' VAL . 1.5 m -60.32 -45.81 92.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.5 -36.46 68.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.64 -51.78 56.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 227' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 224' ' ' SER . 30.0 m -57.62 -35.97 52.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.106 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.7 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.48 -33.71 76.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -31.45 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.79 -51.7 52.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.9 -46.08 72.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.935 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.47 -36.22 75.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.22 -48.78 72.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -54.04 -39.84 66.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.939 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 78.5 m -65.58 -46.45 79.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -55.07 37.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.867 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -44.85 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.78 -35.03 68.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.907 179.991 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -56.84 16.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.15 -34.96 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -56.65 -51.32 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -32.21 66.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -62.02 -24.86 67.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.12 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -51.06 -33.33 25.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.817 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.15 -26.93 9.71 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.437 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -47.38 -40.54 17.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.911 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -59.58 -49.77 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.26 -47.26 86.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.81 -49.7 67.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -40.05 81.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.878 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 51.4 m -60.08 -50.59 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.83 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.89 -46.28 88.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -55.29 -47.92 74.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.895 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.55 -47.58 81.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.64 -47.45 76.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 -36.65 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 78.2 t -66.54 -31.23 52.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -53.02 9.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.43 -34.74 75.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -77.86 -33.96 51.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' VAL . . . . . 0.42 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.0 OUTLIER -56.02 -45.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.149 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.559 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.2 OUTLIER -44.08 -66.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.592 0.71 . . . . 0.0 110.952 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.559 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.81 -30.48 21.99 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.668 2.245 . . . . 0.0 112.313 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . 0.42 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.4 t80 -60.89 -24.07 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -76.33 -50.6 13.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -60.99 -34.66 75.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -47.22 72.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -52.4 65.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.96 -47.59 79.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.06 -22.11 66.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 23.2 tptt -72.34 -46.49 55.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.856 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -26.41 63.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -65.98 -59.98 3.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.83 -34.56 78.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.34 -30.42 67.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -68.81 -54.13 17.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -66.65 -34.45 77.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.71 -26.1 54.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -65.85 -54.2 29.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 -33.35 65.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.833 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.408 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 56.6 tt0 -71.57 -24.12 61.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -88.47 -48.68 7.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.906 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.88 -31.54 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.088 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.7 mt-10 -55.59 -64.64 2.01 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.628 0.728 . . . . 0.0 110.88 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.7 Cg_endo -69.81 -52.73 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.71 2.274 . . . . 0.0 112.304 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.47 -63.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.74 -31.25 2.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -77.59 -45.78 24.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 0.0 110.893 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -68.7 -46.64 68.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.94 -51.82 65.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -60.52 -42.14 95.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -66.46 -51.4 57.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -60.86 -32.08 71.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.76 -47.83 76.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -58.81 -45.82 89.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.868 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.3 -33.52 67.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.09 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -69.0 -50.36 49.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.17 -41.13 90.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -53.26 -52.68 58.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -48.73 73.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.076 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.16 -37.92 72.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -44.24 77.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.849 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.71 -42.41 79.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -81.43 -29.77 33.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 35.1 tp -70.86 -18.29 62.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.949 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' ALA . . . . . 0.482 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -59.69 -62.96 4.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.589 0.709 . . . . 0.0 111.123 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.79 -44.0 2.31 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.703 2.269 . . . . 0.0 112.35 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -58.41 -27.76 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 1.1 m -64.19 -48.74 74.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -62.1 -47.28 85.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.872 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.09 -52.26 56.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.47 -48.32 81.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 8.8 mmp_? -56.5 -37.33 70.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -45.34 91.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.89 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -63.73 -47.58 80.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.842 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.28 -43.58 94.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.22 -36.99 69.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.94 -34.62 64.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.135 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -33.57 76.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 9.0 tt -73.49 -48.98 29.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.939 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.59 56.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.86 -49.45 73.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.64 -36.11 81.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.2 -27.73 68.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.922 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.48 -56.29 18.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.66 -46.84 83.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.906 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -57.43 -32.45 64.36 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.7 71.55 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.537 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.14 -54.11 7.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -55.77 -28.57 56.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.97 -47.77 77.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.911 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.66 -48.56 59.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.25 -34.09 73.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.934 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -64.48 -47.28 79.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.923 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.5 -47.85 72.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.86 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.33 -30.71 71.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.064 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -49.76 20.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.07 -39.19 86.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.0 -46.99 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.124 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.99 -39.25 90.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.93 -38.04 78.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.21 -34.22 65.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.946 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 8.4 m -57.1 -50.67 72.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.44 -51.35 60.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.118 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -47.86 72.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.969 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 24.3 p -59.35 -33.53 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.58 -47.01 88.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.915 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -32.41 58.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.49 -20.25 63.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.51 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -60.0 -62.92 4.92 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.589 0.709 . . . . 0.0 110.888 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 209' ' ' PRO . . . . . 0.51 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.2 Cg_endo -69.77 -27.13 26.79 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.717 2.278 . . . . 0.0 112.347 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.81 -35.65 59.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.121 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 18.4 mt -69.66 -34.7 74.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.941 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.47 -50.94 64.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -71.21 -34.79 71.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.72 -50.53 73.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -36.31 83.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -56.76 -48.6 77.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 217' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -66.59 -29.24 74.44 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.526 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 7.9 tp -66.08 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 219' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.6 OUTLIER -48.7 -60.77 4.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 220' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.78 -38.58 7.56 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.677 2.251 . . . . 0.0 112.339 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 47.7 t -58.09 -54.28 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -35.12 74.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.35 -37.17 86.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.921 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 224' ' ' SER . . . . . 0.429 ' O ' HG23 ' B' ' 227' ' ' VAL . 1.5 m -60.51 -45.81 92.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.45 -36.47 68.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.61 -51.76 57.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 227' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 224' ' ' SER . 30.9 m -57.6 -35.97 52.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.151 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -51.38 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.72 -38.12 89.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.932 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.53 -33.68 76.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -31.37 67.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.81 -51.65 53.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.97 -46.09 72.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.4 -36.36 75.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.12 -48.76 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -53.98 -39.88 66.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 78.3 m -65.6 -46.41 79.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.142 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -55.08 36.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.865 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -44.83 80.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.895 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.74 -35.03 68.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 179.937 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.962 0.41 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.6 p -127.44 44.39 2.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.153 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.08 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -56.91 -43.13 81.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -72.44 -42.95 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -43.31 98.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -43.69 73.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -57.52 -46.94 83.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -27.86 50.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.53 -47.41 73.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 96.73 74.65 1.21 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.52 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -16.02 37.23 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.614 2.209 . . . . 0.0 112.348 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -55.25 -36.18 39.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.159 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.8 t -58.25 -39.54 79.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.146 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -59.8 -51.25 70.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -66.85 -27.32 67.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.65 -61.68 2.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 21.4 p-90 -69.7 -32.61 71.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.937 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -67.0 -53.06 35.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.816 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -62.97 -43.96 97.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.919 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -57.5 11.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -58.03 -35.21 70.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.922 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -58.62 -52.07 67.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.94 -32.83 63.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.14 -25.96 68.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.168 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.76 -34.38 27.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.91 -27.76 14.61 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.441 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -48.62 -37.31 17.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.831 0.348 . . . . 0.0 110.921 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -59.65 -44.71 93.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.93 -49.61 73.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 6.4 mtp -58.16 -41.56 84.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.75 -50.61 73.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.58 -44.34 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -47.41 79.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.45 -49.67 75.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -54.34 -47.8 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.06 -34.92 79.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.94 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 69.3 t -66.41 -32.3 57.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.14 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -74.93 -52.91 10.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.54 -33.65 75.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -77.53 -33.42 54.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.67 -43.07 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.136 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 5.6 mm-40 -44.38 -65.05 0.66 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.586 0.708 . . . . 0.0 110.908 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.4 Cg_endo -69.77 -32.27 18.85 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.672 2.248 . . . . 0.0 112.332 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -58.94 -25.26 63.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.943 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.9 mt -72.5 -50.64 24.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.59 -34.17 77.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -47.74 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.69 -52.22 65.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.74 -45.59 85.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -63.2 -22.61 66.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -73.25 -47.15 45.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -28.41 68.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -66.27 -56.46 11.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -70.28 -34.63 73.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.44 -32.53 71.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -69.2 -54.2 16.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -35.03 79.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.869 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.64 -26.25 54.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -63.33 -55.35 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -73.61 -36.02 65.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.851 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 72.6 tp60 -67.93 -22.56 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -89.07 -36.23 15.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.86 -32.55 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.9 tt0 -59.56 -61.83 7.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.651 0.739 . . . . 0.0 110.859 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.6 Cg_endo -69.7 -52.32 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.677 2.251 . . . . 0.0 112.395 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 28.4 tp -69.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.89 -32.42 2.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.67 -44.66 32.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.814 0.34 . . . . 0.0 110.916 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.71 -42.63 81.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 35.4 mmt -66.82 -47.47 71.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -64.53 -42.94 95.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.8 -52.77 22.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -59.99 -34.9 73.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.844 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.67 96.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.099 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -63.27 -48.27 78.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.03 71.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.101 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -69.31 -50.69 44.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.41 -41.58 89.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -52.85 -52.26 57.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.93 75.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -39.27 74.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.947 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -45.12 75.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.908 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 22.6 m -55.88 -41.83 75.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.69 -31.5 32.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.13 -22.76 62.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.476 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -54.63 -62.56 3.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.577 0.703 . . . . 0.0 111.142 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.5 Cg_endo -69.83 -44.17 2.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -59.13 -31.37 68.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.938 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.8 t -56.71 -52.12 66.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.875 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.59 -47.57 80.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.871 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.8 -51.28 69.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -58.95 -44.71 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.926 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.21 -35.57 67.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -50.04 60.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.54 -40.11 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.6 tp -70.0 -49.82 47.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.92 -34.31 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.15 -34.22 56.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.125 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -62.11 -49.05 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.99 -49.31 65.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.39 -49.59 77.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.84 -46.8 78.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.86 -39.67 74.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -67.55 -28.17 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.868 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.75 -56.1 20.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.848 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.84 -27.53 65.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.16 -31.25 65.24 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.3 -48.7 66.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.48 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.25 -23.1 38.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.766 0.317 . . . . 0.0 111.054 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.81 -30.53 62.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.816 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -43.62 98.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.8 -48.82 43.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.097 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.94 -50.52 73.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -56.12 -46.7 79.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.919 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.19 -50.73 61.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.844 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.36 -31.01 68.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.123 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.41 -49.09 17.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.48 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.0 m -66.58 -48.36 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.147 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 26.3 pt-20 -70.86 -36.1 72.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -58.88 -47.64 84.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 mp -72.29 -29.8 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 58.0 m -56.91 -51.2 70.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 37.0 p -69.39 -50.35 46.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.151 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.41 -55.57 27.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 61.4 m -54.43 -35.88 63.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.875 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.85 -46.99 86.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -78.35 -27.84 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.04 -21.65 63.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.131 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.464 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -62.35 -60.71 9.26 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.561 0.696 . . . . 0.0 110.871 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 54.3 Cg_endo -69.72 -28.34 25.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.685 2.257 . . . . 0.0 112.366 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.78 -31.59 57.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.15 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.8 -38.39 73.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -54.19 -50.57 66.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.03 -31.18 58.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.849 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.59 -52.11 66.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -35.57 78.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.848 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -57.2 -48.91 77.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.866 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.422 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.82 -29.79 72.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.481 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.36 -32.4 73.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.8 OUTLIER -52.48 -61.65 4.31 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.595 0.712 . . . . 0.0 110.896 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.78 -43.79 2.44 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.661 2.241 . . . . 0.0 112.364 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 57.0 t -57.2 -55.08 22.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.14 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.73 -33.19 71.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -68.43 -34.98 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.93 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.92 83.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.858 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -65.6 -42.57 91.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.34 -44.84 90.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 42.9 t -55.54 -42.69 69.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.102 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -49.82 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -65.08 -38.5 90.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.96 -34.05 77.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.21 -30.98 65.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.88 56.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.069 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -67.18 -36.54 81.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.945 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.16 -35.97 69.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.78 -49.14 32.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.87 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.31 -37.27 80.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.9 m -71.04 -46.37 62.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.161 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -56.46 -53.93 51.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.87 -48.79 78.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.9 -34.53 69.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -72.97 -26.46 61.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.0 m 73.92 -68.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.949 0.404 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 29.3 p -128.01 44.43 2.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.159 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -128.24 -67.42 0.81 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.7 m -56.99 -43.1 81.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.859 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -72.45 -43.0 64.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.97 -43.24 99.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.91 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.16 -43.81 73.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.847 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -57.42 -47.0 82.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.71 -27.91 50.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.59 -47.32 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 96.69 74.58 1.21 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.505 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -16.2 37.68 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.668 2.245 . . . . 0.0 112.361 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.14 -36.07 37.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.173 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 8.7 t -58.34 -39.57 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.139 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.74 -51.31 70.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -66.86 -27.36 67.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.53 -61.75 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 21.8 p-90 -69.7 -32.63 71.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.897 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -66.94 -53.02 35.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.03 -44.05 96.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.925 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.45 -57.47 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.946 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.12 -35.3 71.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -58.47 -52.2 66.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -32.81 63.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.3 m -62.09 -25.92 67.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.168 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -34.39 27.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.9 -27.71 14.43 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.488 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 pp -48.7 -37.51 18.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.778 0.323 . . . . 0.0 110.913 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.64 -49.78 76.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -59.68 -44.87 93.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.92 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.73 -49.71 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 6.3 mtp -58.26 -41.42 84.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.79 -50.58 73.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.89 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.64 -44.43 90.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.28 -47.82 77.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.862 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.37 -49.39 76.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.35 -47.4 72.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.929 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.68 -34.95 79.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.9 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.48 -32.15 56.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.159 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -75.5 -53.29 8.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.91 75.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.104 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -77.76 -33.69 52.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.881 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . 0.422 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.0 OUTLIER -55.43 -46.43 78.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.561 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 5.2 mm-40 -43.48 -66.24 0.47 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.576 0.703 . . . . 0.0 110.913 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.561 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.73 -31.46 20.62 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 0.0 112.349 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . 0.422 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.5 t80 -58.66 -24.7 61.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.88 -50.14 15.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.929 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.83 -34.38 73.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.69 -47.56 69.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.09 -52.61 63.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.31 -46.16 84.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -62.2 -22.56 66.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.872 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -72.95 -47.41 45.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.89 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.86 -30.82 71.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -63.98 -56.4 15.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.14 -34.29 72.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -70.57 -31.68 68.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.904 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -69.95 -54.48 13.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.15 -35.52 81.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.51 -25.94 54.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.953 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -63.13 -55.57 24.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.932 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -74.43 -33.94 63.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.443 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 72.6 tp60 -69.58 -21.93 63.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -91.24 -36.31 13.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.68 -32.62 58.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.8 tt0 -60.67 -61.45 7.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.672 0.749 . . . . 0.0 110.89 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.75 -51.54 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.342 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 23.3 tp -70.84 -64.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.4 -32.21 1.76 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.462 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -77.74 -47.32 19.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 110.882 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 -45.68 78.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.5 mmt -64.91 -51.94 59.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.836 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.7 tpp85 -60.29 -43.59 96.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -66.75 -51.69 52.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.848 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.49 -31.91 70.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.48 -47.27 76.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.088 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 12.8 tpt85 -59.16 -45.3 91.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.65 -34.19 67.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.133 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -68.87 -50.05 53.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.83 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 8.7 p -65.23 -41.36 91.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -53.06 -51.95 60.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.05 -48.55 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -37.93 73.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -44.96 74.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 22.8 m -56.15 -41.86 76.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.164 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.56 -31.14 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.87 -22.64 62.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.481 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -54.84 -62.52 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.577 0.703 . . . . 0.0 111.121 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.76 -42.43 3.41 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.71 2.273 . . . . 0.0 112.35 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -60.74 -31.16 70.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.943 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.7 t -57.4 -51.85 67.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.829 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.23 -47.64 81.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.27 -51.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.877 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -58.86 -44.45 91.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.914 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.36 -36.07 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -49.44 64.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.25 -41.47 96.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 25.1 tp -69.27 -48.94 60.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.939 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.1 -34.34 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.102 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.41 57.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.124 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -61.98 -48.89 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.6 pp -67.32 -48.96 66.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -50.32 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.61 77.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.063 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -57.13 -39.39 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -68.3 -28.23 67.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -55.76 23.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.854 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.92 -27.38 65.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.24 -31.41 65.8 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.18 -48.81 66.09 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.473 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.15 -23.18 38.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.318 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.72 -30.53 62.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -43.77 98.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.84 -48.68 44.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.117 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.96 -50.41 73.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -56.38 -46.69 79.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.17 -50.22 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.85 -30.97 69.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.3 -48.95 18.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.26 -34.12 76.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.1 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.4 m -65.87 -48.66 70.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -70.91 -36.15 72.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.82 -47.56 84.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.37 -29.75 64.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.926 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 57.7 m -56.98 -51.09 70.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.848 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 36.6 p -69.37 -50.27 47.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.158 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.49 -55.58 27.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.879 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 61.3 m -54.51 -35.85 63.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.835 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.87 -46.88 86.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.888 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -78.47 -27.83 46.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.11 -21.74 63.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.474 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -62.27 -60.75 9.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.554 0.692 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.8 -28.25 25.28 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.711 2.274 . . . . 0.0 112.333 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.95 -31.55 56.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.126 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.62 -38.5 73.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.926 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -54.12 -50.43 66.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -75.88 -31.11 59.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.72 -52.22 66.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -35.46 78.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -57.21 -48.87 77.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -68.89 -29.82 72.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.493 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.31 -32.47 73.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.8 OUTLIER -52.45 -61.67 4.27 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.616 0.722 . . . . 0.0 110.923 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 54.0 Cg_endo -69.73 -43.83 2.45 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 0.0 112.398 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.23 -55.11 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.171 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -33.32 71.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.45 -34.92 76.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -47.96 83.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.856 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -65.64 -42.4 91.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.42 -44.9 89.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.867 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 43.0 t -55.53 -42.67 69.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.118 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.14 -49.82 76.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -65.1 -38.53 91.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.87 -34.09 77.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.907 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.26 -30.91 65.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.55 -50.75 57.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -67.31 -36.42 81.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.2 -36.06 69.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.73 -49.13 33.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.877 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -60.35 -37.24 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.925 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 98.1 m -70.99 -46.44 62.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.169 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 7.1 ttmt -56.45 -53.9 51.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.84 -48.81 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 29.6 mt -57.92 -34.55 69.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.925 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -72.84 -26.51 61.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.0 m 73.88 -67.95 0.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.126 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.7 m . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.958 0.408 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -135.34 -71.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.109 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 56.24 44.83 24.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.8 t -61.59 -41.52 97.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.862 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -35.9 74.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.871 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -42.48 96.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.956 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.98 -46.71 61.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.35 -38.99 92.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -78.04 -28.32 48.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.55 -48.79 65.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.938 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 94.1 73.64 1.22 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.5 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -25.54 28.8 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.685 2.257 . . . . 0.0 112.379 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.5 m -56.37 -44.08 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.137 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 61.3 p -70.64 -57.33 4.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -41.37 64.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.867 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.48 -32.32 66.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -53.53 56.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -73.08 -44.48 60.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.901 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -56.87 -52.28 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -66.72 -41.39 87.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.819 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.85 -55.26 36.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.948 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.61 -33.81 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.885 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.18 -49.4 74.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.54 -34.01 76.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.8 p -73.11 -23.45 60.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -50.96 -31.96 19.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.32 -30.7 40.95 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 pp -51.67 -36.88 48.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.35 -49.67 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.876 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.23 -41.73 98.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.04 -48.08 81.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.3 mmt -62.5 -40.09 95.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -58.76 -50.24 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.869 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -60.56 -46.24 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -55.62 -47.59 76.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.888 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tp -58.15 -50.85 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.08 66.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.836 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -62.64 -37.96 88.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.893 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.34 -31.68 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.138 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -74.93 -53.93 8.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.895 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.57 -30.67 71.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.96 -36.11 42.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.7 t -58.34 -43.33 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.187 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.551 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.9 mm-40 -44.33 -65.23 0.64 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.61 0.719 . . . . 0.0 110.943 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.551 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.9 Cg_endo -69.8 -27.27 26.46 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -53.72 -57.29 11.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.65 -29.13 36.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.929 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.82 -47.04 73.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.04 -42.83 93.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -50.74 72.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.883 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -47.5 85.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -26.2 68.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -45.79 67.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.868 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -23.17 61.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -66.21 -64.83 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -63.4 -34.78 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.892 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -70.51 -30.07 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.874 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -65.65 -51.64 57.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.852 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -40.67 96.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -25.34 56.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -61.92 -54.97 34.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -71.18 -39.26 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.854 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -65.28 -25.67 67.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.35 -40.91 12.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.9 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.409 ' O ' ' HA3' ' A' ' 145' ' ' GLY . 59.0 t -57.61 -31.76 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.544 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.9 mt-10 -60.12 -65.09 2.31 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.587 0.708 . . . . 0.0 110.868 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.544 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 54.1 Cg_endo -69.73 -51.42 0.39 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.714 2.276 . . . . 0.0 112.374 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -63.61 1.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.907 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.18 -31.84 1.48 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.481 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -75.37 -43.58 49.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 0.0 110.857 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -71.83 -37.37 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -67.54 -47.74 69.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.834 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.3 tpp180 -66.31 -39.92 89.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.87 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -71.37 -51.34 24.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -62.46 -38.27 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.22 -42.47 99.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.79 -50.91 70.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.05 70.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.084 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.16 -50.6 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 10.7 p -67.34 -35.53 74.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.129 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -57.3 -51.25 70.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.01 56.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.087 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 22.2 tp -56.76 -42.57 79.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.47 -38.88 81.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.88 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 61.8 m -56.95 -47.61 80.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.09 -34.9 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.87 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.3 tp -72.31 -15.08 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.472 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -62.3 -62.05 6.5 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.609 0.719 . . . . 0.0 111.15 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.73 -39.4 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.364 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -63.16 -34.22 77.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.95 -48.58 73.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -62.02 -49.39 76.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.46 -51.07 68.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 31.7 tp -60.62 -50.04 75.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.57 -34.01 76.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.833 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.23 79.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -49.02 38.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.867 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -51.47 47.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.31 -43.02 74.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.109 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.95 -39.35 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.05 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -33.43 75.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.887 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.76 -50.17 26.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.39 -50.93 57.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.27 76.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.086 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 18.8 tp -63.79 -34.78 78.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -65.28 -33.54 76.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.82 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.53 -45.16 77.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -67.56 -26.28 66.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.12 -33.57 37.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.445 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.1 -32.3 35.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.502 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.25 -25.74 42.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 111.133 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.75 -35.25 65.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -37.18 86.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.907 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.33 38.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.063 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -49.08 77.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.47 -42.69 92.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.84 -50.16 66.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.96 -30.92 70.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.088 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.36 -49.73 18.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.66 -34.82 77.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.156 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.1 m -64.23 -47.67 78.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.14 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.87 -37.77 79.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -42.85 90.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -30.95 64.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 20.3 m -57.18 -51.02 70.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.865 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 4.8 p -67.74 -50.38 57.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.159 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.0 tp -55.06 -53.06 60.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 14.1 m -54.64 -36.17 64.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.814 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -46.27 88.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -28.85 48.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.896 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.08 62.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.473 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 4.4 tptt -61.07 -60.37 10.85 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.589 0.709 . . . . 0.0 110.893 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.71 -29.16 24.54 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.694 2.263 . . . . 0.0 112.41 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.54 -29.82 56.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.085 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tt -72.54 -38.66 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.91 -51.22 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.883 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.75 -31.25 61.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.91 -52.46 62.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.95 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -63.7 -37.76 88.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.874 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -56.67 -48.32 77.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.405 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -66.75 -29.25 74.42 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.457 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.88 -33.07 74.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.836 0.351 . . . . 0.0 110.883 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.462 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.1 mp -48.3 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.583 0.706 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.2 Cg_endo -69.78 -37.72 8.74 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.683 2.255 . . . . 0.0 112.324 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.55 -54.87 27.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -34.98 74.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.22 -34.62 78.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.15 -48.43 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.31 -43.18 70.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -62.49 -48.86 77.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.828 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.74 -38.78 59.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.56 -50.1 75.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.865 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.78 -38.48 90.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.22 -34.76 79.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 10.8 m -70.14 -30.42 67.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.829 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.16 48.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.123 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -69.2 -38.99 78.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.65 -39.65 84.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -72.26 -48.62 41.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.7 -35.89 69.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 93.9 m -70.73 -47.33 60.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.109 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -53.79 52.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -61.73 -48.72 79.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.83 -35.09 70.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -69.01 -28.95 67.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.53 -68.18 0.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.182 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.972 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.943 0.402 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -135.5 -71.38 0.47 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.117 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 56.32 44.93 23.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.859 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 12.8 t -61.65 -41.59 97.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.825 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.21 -35.88 74.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -42.38 96.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.98 -46.76 61.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.865 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.3 -39.01 93.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -78.04 -28.37 48.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -48.92 65.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.942 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 94.19 73.6 1.21 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.485 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -25.38 28.4 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.628 2.219 . . . . 0.0 112.353 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 16.5 m -56.36 -44.01 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.139 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 60.6 p -70.78 -57.29 4.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.96 -41.27 64.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.933 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.47 -32.41 66.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.886 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -53.48 57.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.865 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -73.12 -44.43 60.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -56.91 -52.22 66.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.918 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -66.7 -41.38 88.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.86 -55.34 35.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.52 -33.82 76.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.876 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -49.51 73.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.46 -34.05 76.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.877 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 28.8 p -73.14 -23.4 60.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.123 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.03 -31.93 19.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.893 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.42 -30.7 41.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.476 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.5 pp -51.65 -36.79 47.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -58.49 -49.61 76.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.11 -42.01 98.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.923 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.74 -48.39 79.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.2 mmt -62.27 -40.0 94.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 44.4 m -58.63 -50.23 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.835 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -60.45 -46.52 89.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -55.44 -47.97 75.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.891 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.86 -50.78 72.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.11 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.12 -36.66 84.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.925 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.45 -31.76 55.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -75.21 -54.93 6.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.18 72.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.68 -36.57 43.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 1.3 t -54.22 -47.45 67.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.108 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.57 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.0 mm-40 -42.68 -66.76 0.39 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.562 0.696 . . . . 0.0 110.904 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.57 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.69 -24.32 30.12 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.703 2.268 . . . . 0.0 112.339 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -53.54 -54.98 29.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.941 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.46 -28.36 66.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.87 -48.49 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.848 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.28 -43.94 84.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -51.54 67.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.877 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -47.52 85.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.25 -25.48 64.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.97 -48.93 41.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.918 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -25.63 67.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -68.02 -66.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.9 -35.51 76.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.858 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -70.96 -29.3 65.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.902 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -65.49 -51.37 60.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.826 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -39.11 93.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -25.72 56.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.895 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -64.23 -55.58 20.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.974 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -69.4 -38.61 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -66.6 -24.51 66.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -91.79 -42.56 10.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . 0.4 ' O ' ' HA3' ' B' ' 145' ' ' GLY . 62.2 t -56.98 -31.47 36.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.527 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mt-10 -61.45 -64.85 2.61 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.649 0.738 . . . . 0.0 110.904 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.527 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.4 Cg_endo -69.74 -51.82 0.36 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -63.95 1.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' B' ' 119' ' ' VAL . . . -42.99 -31.0 1.11 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -77.2 -45.21 27.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -70.24 -43.84 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -64.9 -51.2 63.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -62.09 -41.09 97.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.857 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -68.31 -50.92 50.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.815 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -62.26 -33.73 75.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.57 -49.68 72.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.09 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -56.66 -49.54 74.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.897 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.99 -32.93 72.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.106 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.5 -50.15 60.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.837 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.3 -35.55 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.13 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -57.6 -50.78 72.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.1 58.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.109 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 22.0 tp -57.37 -42.21 81.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -39.54 84.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 86.1 m -57.25 -46.88 82.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.48 -34.94 47.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 tp -72.4 -15.37 61.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.93 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.469 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -62.13 -61.96 6.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.582 0.706 . . . . 0.0 111.076 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.73 -38.7 7.5 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -63.86 -34.95 79.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.02 -48.37 76.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -62.2 -49.24 76.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.867 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.4 -51.16 68.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.912 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.61 -50.1 74.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.35 -33.9 76.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -35.33 80.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -48.82 41.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.38 48.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.888 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.56 -42.75 75.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.04 -39.11 63.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.142 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -34.15 77.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.892 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -49.35 33.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -67.19 -50.48 60.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.71 80.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 19.1 tp -64.36 -34.51 78.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -66.62 -33.77 76.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -44.71 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.875 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -68.05 -26.09 65.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.09 -33.59 37.7 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.482 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.0 -32.38 34.58 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.459 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.68 42.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.339 . . . . 0.0 111.128 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.73 -35.69 65.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -37.35 86.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.85 -49.25 39.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.137 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -48.44 79.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.88 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.92 -42.83 94.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.88 -49.99 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.83 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.07 -30.91 70.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.53 -49.6 18.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.71 -35.03 78.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 63.5 m -64.16 -47.56 79.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.163 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.85 -37.88 79.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.847 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -42.74 90.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.849 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.0 -30.9 64.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 20.2 m -57.28 -50.95 71.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 4.9 p -67.68 -50.38 57.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.9 tp -55.09 -53.04 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 13.9 m -54.71 -36.12 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.828 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -46.23 88.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.859 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -28.78 48.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.15 62.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.482 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 4.5 tptt -61.12 -60.3 11.06 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.564 0.697 . . . . 0.0 110.876 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.7 Cg_endo -69.8 -29.17 24.09 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.663 2.242 . . . . 0.0 112.3 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -29.76 56.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.109 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.39 -38.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.84 -51.03 64.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.81 -31.27 61.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.93 -52.45 62.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -63.88 -37.6 88.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -56.64 -48.4 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.407 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -66.79 -29.3 74.49 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.482 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.74 -33.13 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.886 0.374 . . . . 0.0 110.956 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.475 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.1 mp -48.28 -60.79 3.87 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 0.0 110.916 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.8 Cg_endo -69.72 -37.72 8.88 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.675 2.25 . . . . 0.0 112.328 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.65 -54.81 28.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.51 -35.12 75.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.15 -34.61 78.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.844 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.18 -48.46 79.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.789 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.27 -43.21 70.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.1 tttm -62.49 -48.83 77.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 24.8 t -56.69 -38.82 59.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.55 -50.13 74.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.82 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -38.48 90.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.907 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.23 -34.82 79.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.937 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 10.4 m -70.05 -30.41 67.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.45 -50.22 47.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.5 pp -69.12 -39.03 79.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -67.62 -39.56 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.33 -48.62 40.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.66 -35.92 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 93.5 m -70.67 -47.35 60.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -53.76 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -61.82 -48.63 79.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 28.0 mt -57.86 -35.06 70.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.921 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -69.01 -29.04 67.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.63 -68.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.152 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.888 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.935 0.398 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -142.31 85.0 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -103.43 179.73 4.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.843 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -39.2 65.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.933 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -68.46 -43.66 76.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.889 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.8 mt -69.66 -35.6 75.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.973 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 mtt180 -66.78 -50.51 62.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.853 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -37.76 83.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.91 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.62 -25.73 60.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.53 -39.56 64.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.873 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.514 ' C ' ' H ' ' A' ' 67' ' ' VAL . . . 106.47 -161.86 13.96 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.453 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 33.05 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.674 2.249 . . . . 0.0 112.307 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.514 ' H ' ' C ' ' A' ' 65' ' ' GLY . 17.7 m -75.81 -30.28 21.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -43.52 -38.49 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -58.28 -50.02 75.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.925 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.29 -32.89 74.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -62.69 -54.92 31.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.59 -34.86 78.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.946 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.77 -54.13 17.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -65.02 -41.66 95.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.74 -55.13 36.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.31 -38.29 73.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.03 -51.66 67.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -30.72 61.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.4 m -59.25 -22.08 60.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.01 -34.52 13.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.88 -27.15 20.11 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.469 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.31 -35.65 12.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.801 0.334 . . . . 0.0 110.893 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -50.22 74.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.13 -43.81 98.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.41 -49.28 74.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.63 -41.58 86.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -58.62 -50.6 73.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.837 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.83 -45.08 90.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.16 -46.84 79.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.23 -50.39 73.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.78 -48.27 69.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.68 -35.57 81.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.886 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 63.2 t -65.62 -32.29 57.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.162 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.39 -52.77 11.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.73 -33.27 73.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.088 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -78.03 -33.15 51.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.7 t -58.82 -42.68 86.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.178 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 mt-30 -44.6 -64.89 0.71 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.592 0.71 . . . . 0.0 110.918 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.8 -32.9 17.52 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.717 2.278 . . . . 0.0 112.317 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -59.11 -25.22 63.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.951 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.1 -50.88 20.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.8 -32.52 73.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.896 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -47.4 65.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.913 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -56.09 -52.41 64.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.23 -47.54 76.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -61.0 -22.75 64.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.919 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -74.32 -45.98 43.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -30.53 71.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -66.18 -55.88 14.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -69.65 -34.46 74.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.94 -31.73 68.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.03 -54.24 16.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.897 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.51 -35.13 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.62 -25.91 54.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -65.25 -54.62 26.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -41.31 65.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.403 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 39.3 tt0 -62.01 -25.81 67.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -84.81 -39.23 18.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.45 -32.49 48.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.157 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.541 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 4.7 mt-10 -57.61 -64.78 2.28 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.645 0.736 . . . . 0.0 110.921 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.8 Cg_endo -69.74 -51.14 0.4 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.699 2.266 . . . . 0.0 112.356 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.2 tp -67.27 -64.3 0.88 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.23 -32.67 3.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.451 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -74.36 -43.84 54.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -70.89 -35.49 72.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -49.96 64.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -68.12 -37.13 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.879 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -71.24 -53.57 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -61.44 -37.05 82.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.848 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.22 96.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.113 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -49.65 73.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.99 -32.39 69.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -69.82 -50.87 38.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.4 p -67.09 -41.55 87.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.131 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -53.33 -52.63 58.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.31 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.109 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 mp -56.77 -45.3 82.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -63.31 -44.09 95.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.882 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 32.2 m -56.09 -40.78 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.41 -31.23 33.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.34 -22.27 63.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.482 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -54.97 -62.7 3.81 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.549 0.69 . . . . 0.0 111.114 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.83 -45.85 1.4 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.67 2.247 . . . . 0.0 112.347 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.55 -29.13 64.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -52.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.836 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.86 -33.18 75.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.839 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.71 -51.91 30.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.846 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.29 -49.34 64.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.88 -35.95 69.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.87 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -41.9 82.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -72.31 -40.52 67.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.865 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -50.56 38.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.928 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.62 -40.96 80.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.092 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.1 -41.83 61.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.099 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -65.72 -34.15 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.54 -50.07 48.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -69.4 -35.57 75.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.13 -49.17 53.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.125 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.9 -43.15 81.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -70.28 -30.86 67.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.881 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -55.48 31.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.85 -26.79 68.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.74 -34.47 44.39 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.69 -33.3 41.61 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.498 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.39 42.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.32 . . . . 0.0 111.092 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -73.1 -32.67 65.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -39.49 93.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.958 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.38 35.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.08 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -49.56 75.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -57.99 -44.24 87.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -53.64 -49.37 68.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.878 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.41 -31.3 70.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.096 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -49.6 16.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.57 -34.7 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.114 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 86.1 m -65.76 -47.57 74.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.148 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.44 -36.16 76.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.91 -46.44 87.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.837 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -30.13 64.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.03 -51.11 70.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.813 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.64 -50.59 50.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.32 -55.07 32.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.913 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 68.1 m -54.23 -36.03 63.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.84 -46.53 87.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -29.83 52.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.38 -21.89 64.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.506 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 2.1 mttt -60.93 -63.08 4.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.562 0.696 . . . . 0.0 110.921 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.2 Cg_endo -69.78 -26.82 27.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.355 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.04 57.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -72.07 -37.18 69.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.945 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.25 -50.85 66.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -31.06 57.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.838 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.44 -50.93 70.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -35.84 78.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -57.06 -48.94 77.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.418 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.97 -29.78 72.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.459 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -32.66 74.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.85 0.357 . . . . 0.0 110.891 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.475 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -52.34 -61.67 4.23 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.3 Cg_endo -69.8 -43.85 2.38 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.28 . . . . 0.0 112.332 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 54.1 t -57.27 -55.2 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.128 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.65 -33.25 71.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.955 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -68.56 -34.86 76.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 70.6 m -59.96 -47.87 84.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -66.01 -41.93 90.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -45.13 87.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.93 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.38 -42.82 69.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.152 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -49.94 75.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.841 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -64.78 -37.59 88.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.861 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -64.93 -34.52 78.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.919 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.08 -30.48 65.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.02 -50.84 53.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.109 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.43 -35.57 79.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -39.51 69.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.91 -49.2 31.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -57.71 -41.44 81.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.966 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 80.5 m -65.8 -45.56 81.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.118 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.74 53.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 10.8 mtmm -57.78 -49.55 76.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.926 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.36 -35.11 71.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -70.31 -29.46 66.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.61 -68.19 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.102 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.894 -179.983 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.93 0.395 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 26.6 m -142.34 85.06 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.157 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -103.66 -179.88 4.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -39.15 64.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.876 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -68.44 -43.66 76.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.72 -35.62 75.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -66.72 -50.71 61.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -37.87 84.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.87 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.63 -25.75 60.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.53 -39.6 64.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . 0.51 ' C ' ' H ' ' B' ' 67' ' ' VAL . . . 106.51 -162.0 13.89 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.508 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 33.01 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.717 2.278 . . . . 0.0 112.382 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . 0.51 ' H ' ' C ' ' B' ' 65' ' ' GLY . 18.2 m -75.82 -30.27 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 3.1 t -43.44 -38.59 2.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -58.26 -50.0 75.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -62.65 -54.73 35.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.87 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.68 -34.87 78.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.71 -54.15 17.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.847 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.04 -41.62 95.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.903 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.77 -55.16 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.28 -38.3 73.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -51.5 67.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.908 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 93.9 m -59.23 -21.96 60.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.141 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.24 -34.46 15.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.98 -27.15 20.96 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.509 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.39 -35.44 12.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 110.903 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -50.23 74.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -43.82 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.902 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.34 -49.33 74.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.74 -41.34 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.93 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -58.72 -50.48 73.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.92 -45.42 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -47.04 77.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -50.21 73.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -48.12 70.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.866 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.81 -35.6 81.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.841 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.68 -32.34 57.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.83 -53.07 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.893 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 -34.65 74.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.074 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -77.96 -33.48 51.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.909 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . 0.403 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.4 t -55.94 -45.68 80.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.105 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.566 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.9 mt-30 -43.68 -66.16 0.49 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.566 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.8 -32.48 18.34 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.33 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . 0.403 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.0 t80 -58.76 -24.27 61.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.41 -50.07 15.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -59.87 -32.51 70.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.22 -47.11 62.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -55.84 -53.1 60.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.48 -47.66 78.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -60.87 -22.38 64.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -73.51 -47.54 40.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.78 -31.81 73.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -64.03 -56.15 17.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.909 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -70.47 -34.26 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.73 -32.43 69.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -54.21 15.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.841 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.97 -35.6 81.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.67 -25.65 53.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.935 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -65.16 -54.84 23.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.937 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.13 -37.72 66.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -65.62 -24.35 67.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.923 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -88.02 -40.11 14.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 94.5 t -60.11 -32.75 51.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.153 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 4.7 mt-10 -58.45 -64.52 2.74 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.667 0.746 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.8 Cg_endo -69.78 -50.68 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.661 2.241 . . . . 0.0 112.304 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.21 -64.84 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.39 -31.02 3.21 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.467 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -76.51 -44.52 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 110.918 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -70.44 -42.41 71.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 15.8 mmt -65.07 -53.35 47.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.885 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -61.16 -42.34 98.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.839 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -66.43 -51.87 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.79 -32.05 71.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.17 -47.52 76.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.085 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -45.32 91.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.33 -33.67 67.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.077 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -69.68 -50.19 46.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.8 p -65.14 -41.56 92.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -53.67 -52.06 61.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.45 75.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.92 -43.38 81.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -63.46 -44.37 94.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 25.1 m -56.25 -41.39 75.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.148 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -31.13 39.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.13 -22.37 63.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.477 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -54.89 -62.86 3.53 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.579 0.704 . . . . 0.0 111.151 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.3 Cg_endo -69.76 -44.34 2.13 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.675 2.25 . . . . 0.0 112.337 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -58.66 -29.91 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.9 67.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.83 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.48 -33.51 76.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.73 -51.89 30.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 20.5 tp -67.18 -49.34 65.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.921 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.96 -36.22 70.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.6 83.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -72.38 -40.75 67.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.18 -50.35 41.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.974 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.79 -40.73 80.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.21 -41.31 61.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.075 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -66.16 -34.01 77.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.864 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.62 -49.72 51.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.933 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -69.27 -36.42 77.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.906 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -69.68 -49.14 56.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 2.2 tt -57.55 -41.81 81.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -71.73 -31.42 66.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.44 -55.27 33.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.862 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.55 -26.8 68.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.73 -34.58 44.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.462 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.52 -33.37 40.52 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.47 42.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.75 0.309 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -73.02 -32.62 65.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -39.63 93.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.22 36.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -49.5 75.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.04 -44.37 87.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.919 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -53.5 -49.39 67.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.29 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -49.65 16.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.59 -34.68 78.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 85.4 m -65.68 -47.56 75.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.113 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.49 -36.23 76.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.85 -46.39 87.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -30.16 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.01 -51.02 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.61 -50.61 50.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.37 -55.08 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 68.0 m -54.24 -36.06 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.86 -46.51 87.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -30.02 52.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.76 64.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.1 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.513 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 2.1 mttt -61.01 -63.23 4.57 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.586 0.708 . . . . 0.0 110.865 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.77 -26.8 27.15 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 0.0 112.31 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -31.98 57.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.02 -37.18 69.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.13 -50.85 65.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.865 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.32 -31.16 58.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.32 -50.97 70.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.9 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -35.9 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.869 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.07 -48.91 77.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.417 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -68.96 -29.78 72.4 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.494 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.18 -32.63 74.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 0.0 110.908 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.9 OUTLIER -52.39 -61.7 4.21 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.612 0.72 . . . . 0.0 110.885 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.69 -43.96 2.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.719 2.279 . . . . 0.0 112.364 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 57.1 t -57.24 -55.15 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.109 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.72 -33.23 71.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -68.49 -34.84 76.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 70.7 m -60.02 -47.85 84.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -65.84 -42.16 90.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -44.93 88.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.889 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 42.9 t -55.46 -42.86 69.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.159 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.22 -49.96 75.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -64.69 -37.7 88.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.899 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -64.86 -34.5 78.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.1 -30.51 65.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.96 -50.86 53.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.41 -35.64 79.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.0 -39.61 69.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.81 -49.15 32.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.897 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -57.79 -41.45 82.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.908 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 81.3 m -65.77 -45.53 82.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.76 53.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 10.7 mtmm -57.82 -49.51 76.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.48 -35.02 71.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -70.24 -29.51 66.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.62 -68.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.125 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 -179.972 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.954 0.407 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.84 169.59 14.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.092 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -143.59 175.79 9.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -67.36 -41.18 85.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 pttm -67.94 -40.79 83.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.912 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -34.26 69.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -67.7 -50.94 55.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.884 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -66.63 -44.95 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.64 -22.6 66.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.978 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -32.38 62.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.896 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.444 ' C ' ' H ' ' A' ' 67' ' ' VAL . . . 116.41 -161.69 12.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.511 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 41.04 0.32 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.673 2.249 . . . . 0.0 112.344 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 65' ' ' GLY . 22.6 m -77.09 -30.18 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.108 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 97.2 m -44.63 -35.96 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.143 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.49 -50.87 71.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -70.96 -27.65 63.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.89 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -63.87 -60.51 3.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 6.6 p-90 -64.94 -35.0 79.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.66 -53.77 25.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -66.68 -36.85 83.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.07 -55.25 27.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.53 -38.7 81.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.941 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.07 -50.94 69.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.21 -32.62 61.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.872 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.9 m -65.92 -23.92 66.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.47 -33.66 22.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.98 -30.73 54.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.487 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -51.73 -36.31 46.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.807 0.336 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -49.79 75.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -41.3 96.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -48.34 81.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -40.05 96.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -50.6 73.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.78 -46.01 91.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.92 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -56.1 -47.59 77.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.875 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -51.47 69.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -47.8 65.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.26 -38.41 91.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.0 -31.75 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -74.96 -54.26 7.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.2 -30.16 70.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.156 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -79.0 -36.64 40.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.1 t -57.03 -45.0 83.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.122 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.552 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.3 mm-40 -43.84 -65.43 0.59 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.578 0.704 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.552 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 54.0 Cg_endo -69.76 -25.63 28.38 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.639 2.226 . . . . 0.0 112.367 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -53.56 -58.14 8.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -54.92 -28.57 51.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.02 -47.62 73.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -44.19 87.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.863 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -50.52 72.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.89 -47.35 86.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -60.93 -26.24 67.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.927 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -45.27 62.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.895 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . 0.514 ' HE1' ' NH1' ' B' ' 149' ' ' ARG . 0.0 OUTLIER -69.96 -23.3 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -68.12 -64.48 0.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -62.94 -34.97 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.64 -30.32 66.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.924 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 45.3 ttp -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.9 -41.31 97.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -24.79 55.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.958 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -63.66 -55.05 26.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -69.95 -42.72 72.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.33 -26.61 67.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.876 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -89.63 -37.81 14.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.401 ' O ' ' HA3' ' A' ' 145' ' ' GLY . 50.8 t -58.47 -31.73 43.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -60.91 -64.78 2.71 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.67 0.748 . . . . 0.0 110.903 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.75 -51.03 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.677 2.251 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.9 -63.48 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.401 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -44.11 -30.72 1.9 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.524 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.32 -43.72 60.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.859 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -74.95 -33.92 61.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -48.65 68.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -37.15 77.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -71.0 -50.82 30.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.7 -37.97 89.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.13 -43.51 98.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -62.18 -50.62 71.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.29 -30.29 69.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.118 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 35.7 t60 -68.36 -50.44 53.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.848 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.9 p -66.65 -37.26 79.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.161 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -57.2 -52.94 63.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.91 -49.15 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 6.2 mt -56.43 -49.57 74.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 23.5 mmt-85 -60.17 -39.4 86.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 95.0 m -57.3 -48.04 79.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -76.14 -35.14 59.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.84 -15.64 62.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.478 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -61.19 -62.43 5.98 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 0.0 111.133 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.478 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.8 -41.37 4.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.73 2.286 . . . . 0.0 112.323 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -61.57 -34.73 76.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.6 t -60.99 -45.76 93.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -62.56 -50.92 69.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.859 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.32 -51.43 69.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.25 -46.57 86.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.8 tpt85 -60.39 -38.09 82.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -34.65 78.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.14 -49.0 60.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.77 -50.92 30.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.945 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.2 -45.84 72.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.35 -36.03 71.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -32.35 72.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 4.8 tp -72.26 -50.88 23.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.48 -45.0 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.69 93.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 55.4 tp -58.81 -40.87 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -66.26 -31.82 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -55.3 33.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -65.74 -26.23 67.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.19 -33.66 38.55 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.502 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.23 -32.7 37.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.507 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.22 42.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.738 0.304 . . . . 0.0 111.078 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -72.91 -34.36 66.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.882 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.67 86.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.58 36.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.01 -48.77 77.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.892 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.27 -43.93 92.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -53.27 -50.58 64.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.851 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.15 69.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -49.31 18.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.55 -36.72 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.081 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 21.1 p -63.17 -47.58 82.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.148 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -35.96 80.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.55 -45.95 87.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.64 -30.24 65.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.943 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -50.9 71.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 54.3 m -68.18 -50.15 56.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.11 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.58 -54.05 46.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 67.0 m -54.59 -36.14 64.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.61 -47.78 83.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.905 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.2 -28.07 48.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.845 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.16 -22.08 63.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.152 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.494 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -60.22 -62.59 5.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.577 0.703 . . . . 0.0 110.908 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.494 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.81 -27.11 26.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.274 . . . . 0.0 112.354 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.82 -30.94 56.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.126 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.99 -37.52 66.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.879 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.06 -50.81 65.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.885 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.01 -30.71 61.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -51.35 70.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -37.18 81.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.73 -49.09 76.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.423 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.19 -29.42 73.3 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -62.98 -32.93 74.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 110.928 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -52.17 -61.77 4.03 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.583 0.706 . . . . 0.0 110.935 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.72 -43.74 2.52 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.703 2.269 . . . . 0.0 112.338 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.26 -53.69 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.182 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.63 -33.52 71.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.0 -36.0 82.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 47.7 t -61.84 -48.32 81.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.13 -41.06 82.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.919 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.76 -45.44 86.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.929 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 28.9 t -56.8 -41.57 75.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.148 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.96 -50.12 75.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.05 -38.08 84.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.09 -35.87 79.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.48 -30.53 67.36 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.84 -51.29 57.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.12 -41.05 74.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.29 -43.4 98.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.28 -47.57 76.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.85 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -53.99 -39.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 13.0 m -67.04 -44.8 79.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.11 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -55.5 33.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.31 -49.07 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.84 -39.81 78.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -84.55 109.63 18.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 12.1 p -60.22 -74.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.03 169.64 14.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.66 176.26 9.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.894 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -67.88 -41.07 83.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.836 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 pttm -68.02 -40.78 82.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -34.33 69.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -67.75 -50.91 54.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.906 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -66.58 -44.92 80.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.933 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.73 -22.6 66.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -32.22 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.921 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' B' ' 67' ' ' VAL . . . 116.24 -161.73 12.86 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.489 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 41.02 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.669 2.246 . . . . 0.0 112.36 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . 0.441 ' H ' ' C ' ' B' ' 65' ' ' GLY . 22.5 m -77.01 -30.13 17.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.147 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 97.0 m -44.72 -35.88 2.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.55 -50.79 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.954 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -71.02 -27.67 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -63.83 -60.48 3.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 6.5 p-90 -65.01 -34.87 79.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.908 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.88 -53.67 24.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.889 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -66.67 -36.78 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.2 tp -63.14 -55.26 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.92 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.52 -38.71 81.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.04 -50.96 69.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.947 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -75.18 -32.69 61.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.885 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -65.77 -23.91 66.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.4 -33.63 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.95 -30.79 54.66 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -51.68 -36.42 46.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.8 0.333 . . . . 0.0 110.931 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -49.78 75.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.825 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -41.49 97.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -48.61 80.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -40.22 96.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -50.4 73.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.49 -46.73 88.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.85 -47.91 76.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.9 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.8 -51.57 69.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.86 -47.96 64.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.45 -37.31 86.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 88.6 t -65.7 -32.03 56.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.163 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -75.08 -55.49 5.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.945 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.98 -31.75 70.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.068 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt -78.78 -37.44 41.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 1.6 t -51.79 -51.6 26.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.172 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.576 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mm-40 -39.88 -67.27 0.29 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 110.895 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.576 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.76 -20.65 34.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 0.0 112.37 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.48 -55.55 24.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -62.24 -28.39 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.969 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -49.23 78.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.07 -43.84 77.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.814 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.25 -50.81 71.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.844 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.7 -47.71 84.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -59.53 -25.41 64.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.39 -47.34 50.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.962 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -25.92 66.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -67.51 -65.58 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -60.97 -35.65 77.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.41 -29.9 66.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.886 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 39.3 ttp -65.63 -51.13 61.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.06 -41.27 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mp -75.83 -24.65 55.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -63.74 -55.09 25.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -71.14 -39.55 71.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -25.67 68.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -91.8 -39.11 11.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 45.0 t -58.85 -31.29 44.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.148 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.531 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -61.58 -64.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.662 0.744 . . . . 0.0 110.889 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.531 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.76 -50.61 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -63.82 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.63 -30.35 1.46 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.502 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.61 -45.0 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.815 0.34 . . . . 0.0 110.907 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -74.56 -35.78 63.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.37 47.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . 0.514 ' NH1' ' HE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -65.57 -36.83 84.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.876 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.47 -50.72 50.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 2.8 ttp85 -64.14 -34.44 78.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.38 70.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -56.67 -50.04 73.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.97 70.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.11 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -68.75 -49.98 54.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.03 -36.76 78.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.71 -52.06 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.47 -49.51 68.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 6.2 mt -56.8 -48.03 78.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.82 -40.12 91.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 92.5 m -57.47 -46.69 83.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.141 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -76.49 -35.73 58.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.84 -15.76 62.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.48 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -60.78 -62.17 6.5 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.571 0.7 . . . . 0.0 111.108 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.6 Cg_endo -69.79 -42.24 3.54 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.663 2.242 . . . . 0.0 112.336 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -60.81 -33.55 73.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.4 t -61.49 -46.22 90.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.821 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -62.41 -48.9 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.96 -51.87 67.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 11.3 tp -61.2 -49.19 78.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -62.31 -34.56 76.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.7 -34.77 79.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -47.11 57.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.0 tp -70.17 -51.12 33.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.08 -45.12 75.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.3 -34.81 70.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.125 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -32.5 71.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.886 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 4.9 tp -71.76 -50.22 31.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -67.35 -43.21 82.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.893 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.39 90.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.079 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 54.9 tp -60.03 -38.28 82.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -69.67 -32.22 70.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -55.13 35.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.885 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.62 -26.15 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.14 -33.75 38.36 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.481 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.12 -32.8 36.38 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.502 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.17 42.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.116 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -73.03 -34.29 66.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.836 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.71 87.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.02 -49.39 37.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.119 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.06 -48.7 77.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.42 -43.77 92.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.892 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -53.46 -50.42 65.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.851 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.03 -31.17 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.082 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.63 -49.24 19.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.79 83.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.091 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 21.2 p -63.12 -47.45 82.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.168 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -35.94 80.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.87 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.65 -45.89 88.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.844 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.62 -30.28 65.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -50.94 71.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.836 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 54.1 m -68.14 -50.07 57.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.164 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.64 -53.93 48.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.953 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 66.7 m -54.75 -36.07 64.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.868 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.67 -47.77 83.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.17 -28.03 48.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.9 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.12 63.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.503 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -60.13 -62.66 5.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.524 0.678 . . . . 0.0 110.927 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.3 Cg_endo -69.81 -27.06 26.72 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.666 2.244 . . . . 0.0 112.338 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.92 -30.88 56.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.094 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.08 -37.41 66.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -53.89 -50.81 65.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -30.92 61.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.65 -51.57 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.898 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -37.57 82.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.68 -49.07 76.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.415 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -67.88 -29.51 73.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.49 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.03 -32.79 74.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.939 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.3 mp -52.18 -61.74 4.07 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.609 0.719 . . . . 0.0 110.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.77 -43.69 2.5 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.671 2.247 . . . . 0.0 112.325 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 54.6 t -57.27 -53.86 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.106 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.5 -33.55 71.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.93 -35.91 82.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.889 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 47.8 t -61.97 -48.3 80.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -68.13 -41.07 82.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.8 -45.49 86.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.887 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 27.3 t -56.71 -41.65 75.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.105 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.02 -50.07 75.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.828 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -38.15 85.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.07 -35.85 79.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.47 -30.53 67.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.83 -51.41 55.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.09 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.94 -41.15 74.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.26 -43.55 97.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.866 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.22 -47.51 76.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -54.03 -39.2 65.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.92 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 12.9 m -66.96 -44.68 79.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.164 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -55.6 31.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.874 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.2 -49.08 78.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -39.78 78.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.9 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -84.57 109.69 18.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 12.3 p -60.3 -74.34 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.118 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.901 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.92 0.391 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 11.7 t -98.87 154.67 17.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.149 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.38 159.06 42.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 m -72.22 -36.05 69.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.862 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -62.72 -43.0 99.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.911 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -34.35 77.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.904 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmt180 -69.05 -53.81 18.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.845 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.62 -35.63 81.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.29 -24.83 50.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -51.34 -44.17 61.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 91.61 -153.33 22.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -6.21 18.07 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 63.5 t -60.9 -30.19 46.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.133 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 9.1 t -45.87 -35.15 4.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.81 -48.65 80.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.912 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -69.54 -32.52 71.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -65.14 -52.39 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.91 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -35.92 82.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.903 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -64.77 -52.87 54.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -69.58 -35.36 75.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.3 tp -62.33 -55.4 28.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.26 -33.28 75.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -44.37 81.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.17 -37.48 63.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 36.3 p -61.84 -21.04 64.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.099 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.09 -31.7 8.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.82 -29.85 43.01 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.466 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.17 -35.25 35.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.845 0.355 . . . . 0.0 110.947 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -50.1 74.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.92 -40.87 95.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -47.41 85.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -40.79 98.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.86 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -58.32 -50.68 72.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.866 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -45.27 95.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.92 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.52 -48.01 78.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.5 -51.61 68.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.15 -47.86 65.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -63.74 -36.8 85.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.852 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 77.6 t -65.8 -32.11 56.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.087 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -74.94 -54.28 7.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.39 71.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.118 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.89 -35.94 42.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.1 t -57.56 -44.79 85.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.118 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.548 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.4 mt-30 -43.81 -65.18 0.62 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.584 0.707 . . . . 0.0 110.894 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.3 Cg_endo -69.71 -26.22 28.02 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.341 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -52.93 -58.48 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 pp -54.83 -27.84 45.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -43.81 85.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.87 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -71.97 -37.26 69.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.68 -53.23 58.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.894 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -42.86 98.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -62.56 -28.05 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.89 -45.79 60.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -24.01 64.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -66.75 -65.22 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.62 -35.47 77.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -71.1 -29.77 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -64.42 -51.29 63.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.883 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.48 -41.02 98.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.69 -24.12 56.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.68 -55.76 20.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.892 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -63.44 -24.88 68.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.892 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -92.73 -32.99 14.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.421 ' O ' ' HA3' ' A' ' 145' ' ' GLY . 42.6 t -62.6 -32.07 54.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.158 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 9.4 tt0 -63.28 -61.7 6.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.3 Cg_endo -69.77 -51.21 0.4 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.702 2.268 . . . . 0.0 112.329 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.68 -62.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.937 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.421 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.72 -30.72 1.61 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.474 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.79 -43.73 53.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.804 0.335 . . . . 0.0 110.855 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -37.4 64.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -48.99 67.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.9 tpp85 -67.77 -38.4 83.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.868 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -70.42 -50.87 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -38.06 89.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.839 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.53 -43.74 98.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.058 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -60.96 -51.25 70.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.857 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.02 -29.97 69.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.117 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -67.85 -51.07 52.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.84 -39.47 84.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.61 -52.56 61.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.82 -48.3 74.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.108 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -42.57 78.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.832 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.8 -47.49 82.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.112 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -78.83 -35.51 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.8 tt -71.68 -15.4 62.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.48 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -61.25 -62.69 5.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 0.0 111.142 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.76 -40.81 4.89 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -61.92 -34.64 76.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -61.27 -46.19 91.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.874 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.54 -48.95 78.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.889 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.08 -52.01 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 12.4 tp -59.58 -50.14 75.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -63.71 -34.38 77.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.9 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -35.38 79.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.19 -50.82 24.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.96 -51.72 56.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.916 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.91 -44.83 74.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.061 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.71 -35.09 70.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -65.84 -33.1 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.4 tp -73.8 -51.06 17.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.74 -50.33 65.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.83 -47.74 79.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.119 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 59.1 tp -56.81 -40.03 75.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -65.94 -32.73 74.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -55.0 37.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -67.78 -26.13 65.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.9 -33.95 36.93 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.491 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.86 36.17 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.462 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.76 43.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.766 0.317 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -73.27 -35.89 66.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.29 -37.44 85.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.96 -49.01 41.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.164 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -50.75 71.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.91 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.12 -42.22 85.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -53.95 -49.49 68.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.12 70.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.56 -49.91 17.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.26 79.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 59.3 m -64.21 -47.79 78.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.147 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -36.74 80.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.857 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -58.93 -43.8 91.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.34 -31.02 65.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -50.94 71.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 23.1 p -67.72 -50.41 57.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.113 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.59 -52.69 61.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 27.5 t -55.23 -35.84 65.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.848 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.87 -48.07 82.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -29.18 50.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.43 -21.55 63.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.111 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.497 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 1.8 mtpp -59.86 -62.54 5.69 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.615 0.722 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.71 -27.26 26.92 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 0.0 112.343 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.5 -31.85 57.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.121 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -72.8 -37.46 67.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.85 -51.33 63.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.78 61.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.97 -50.8 70.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.945 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.23 -37.48 85.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.829 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -56.52 -48.31 77.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.926 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.432 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -68.81 -28.39 73.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.508 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 23.3 tp -66.07 -33.33 75.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.83 0.348 . . . . 0.0 110.931 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.9 tp -49.98 -60.13 5.69 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 0.0 110.911 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.1 Cg_endo -69.77 -39.56 6.34 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.692 2.261 . . . . 0.0 112.345 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.35 -54.49 32.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.02 -34.88 73.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -64.85 -35.17 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.882 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.03 -48.54 79.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.85 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -40.76 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.862 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.21 -47.7 78.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.79 -40.17 69.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.153 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.64 -50.18 74.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -61.34 -38.65 87.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.885 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -35.28 79.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.896 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 8.8 m -69.9 -30.15 67.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.9 -50.96 45.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.11 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -42.05 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.0 -38.82 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.66 -47.3 63.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -54.07 -39.23 66.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.892 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 36.5 p -69.27 -45.63 69.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.149 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.41 -54.3 42.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.92 -36.3 81.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.877 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 9.5 mt -57.57 -40.94 80.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 176.75 98.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 53.0 m -163.35 -43.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.113 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.926 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.966 0.412 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 11.8 t -97.72 153.51 18.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.133 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.44 160.66 43.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.7 m -73.8 -37.1 65.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.844 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -62.41 -42.3 99.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.926 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -34.45 77.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -69.32 -53.67 18.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.908 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.64 -35.8 81.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.31 -24.49 50.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.93 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -51.29 -43.88 61.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 91.1 -153.58 22.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.479 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -6.25 18.13 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.686 2.257 . . . . 0.0 112.33 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 64.0 t -60.97 -30.11 46.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.11 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 9.0 t -45.96 -35.2 4.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -48.59 80.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -69.59 -32.53 71.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.854 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -65.15 -52.34 55.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.883 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -35.93 82.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.859 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 11.9 t0 -64.74 -52.8 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -69.68 -35.38 75.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.891 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 9.3 tp -62.2 -55.42 28.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -33.29 75.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.887 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.909 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.09 -37.94 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 36.8 p -61.33 -20.94 63.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.108 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.08 -31.8 8.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.74 -29.9 42.45 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -51.17 -35.33 35.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 110.945 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -50.12 74.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.79 -40.95 96.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.02 -47.73 84.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -40.56 98.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -58.24 -50.52 73.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -45.47 93.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.882 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -48.27 77.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.896 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 8.0 mt -57.38 -51.6 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.86 -47.87 64.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -64.14 -36.08 82.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.44 -32.16 56.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.158 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 2.2 tmtt? -75.28 -55.27 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.73 70.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.135 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -78.85 -36.68 41.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -52.76 -50.59 41.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.573 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mt-30 -40.77 -66.75 0.35 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.533 0.682 . . . . 0.0 110.926 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.9 Cg_endo -69.78 -21.72 33.0 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.675 2.25 . . . . 0.0 112.349 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -52.89 -56.14 18.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.875 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 pp -61.19 -28.19 68.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -45.9 90.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.844 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -73.09 -38.0 66.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.09 -53.5 56.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.874 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -42.66 99.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.873 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -61.84 -26.99 68.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -72.79 -47.94 42.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -26.67 68.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.24 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.11 -35.52 77.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -71.22 -29.46 65.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -64.44 -50.67 66.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -64.19 -40.22 95.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.26 -24.76 57.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -65.18 -55.66 17.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -39.47 83.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -66.2 -24.95 66.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -92.24 -37.79 12.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.923 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.4 -31.86 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.516 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.4 mt-10 -61.85 -63.86 3.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 0.0 110.872 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.73 -50.39 0.47 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.276 . . . . 0.0 112.363 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -63.89 1.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.99 -30.16 1.67 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.5 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.31 -44.34 37.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.866 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -44.36 61.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.859 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -51.78 62.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -61.62 -42.04 98.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.68 -50.49 62.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -33.78 75.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.63 -50.75 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.074 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -55.98 -50.34 71.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.881 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.66 -30.87 70.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.109 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -67.92 -50.63 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.35 -39.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -54.66 -52.28 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.97 -48.27 74.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.062 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.76 -42.38 79.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -66.41 -39.18 88.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.79 -47.29 82.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.155 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -79.03 -35.35 42.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.829 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.9 tt -71.76 -15.93 62.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.887 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.488 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -60.65 -62.66 5.52 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.605 0.717 . . . . 0.0 111.122 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.75 -40.15 5.67 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 0.0 112.356 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -62.71 -34.32 76.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.892 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -61.35 -46.45 90.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.86 -48.16 81.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.44 -51.86 63.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 12.4 tp -60.08 -49.56 77.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -63.89 -34.29 77.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.76 -35.73 80.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.03 -50.82 25.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -51.58 58.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.25 -44.31 75.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.113 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.82 -35.05 69.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -65.25 -33.86 77.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.52 -50.53 20.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.925 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.32 -47.55 76.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -60.04 -48.74 80.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 57.9 tp -57.3 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -70.36 -33.7 71.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -54.16 47.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.846 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -67.95 -25.95 65.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.85 -33.87 36.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.516 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.03 -32.19 34.45 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.46 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.32 -25.51 42.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.327 . . . . 0.0 111.102 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 8.3 ttp180 -73.01 -36.81 67.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.897 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -37.26 83.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.935 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.91 -48.82 42.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.094 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -51.29 69.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -57.91 -42.48 84.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -53.52 -49.67 67.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.85 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.29 -31.05 70.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -75.51 -49.87 17.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.909 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.39 -35.44 79.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.118 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 56.5 m -64.02 -47.72 79.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -36.76 80.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.892 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -58.97 -43.57 91.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.51 -31.05 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -50.87 71.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 23.2 p -67.66 -50.41 57.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 26.7 tp -54.68 -52.65 61.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.882 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 27.7 t -55.25 -35.79 65.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.839 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.96 -48.04 82.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.87 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.18 50.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.58 -21.41 63.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 1.8 mtpp -59.98 -62.53 5.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.555 0.693 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.5 Cg_endo -69.78 -27.24 26.61 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.686 2.257 . . . . 0.0 112.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.58 -31.87 57.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -72.66 -37.5 67.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.94 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.88 -51.17 64.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.77 61.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.81 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -62.09 -50.85 70.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.15 -37.49 85.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.842 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -56.45 -48.37 77.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.427 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -68.76 -28.37 73.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.494 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 23.4 tp -66.12 -33.32 75.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.488 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.9 tp -50.07 -60.03 5.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.598 0.713 . . . . 0.0 110.918 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.9 Cg_endo -69.76 -39.63 6.28 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.662 2.241 . . . . 0.0 112.369 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.36 -54.51 31.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.161 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.01 -34.87 73.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -64.9 -35.11 80.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.09 -48.52 79.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.854 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -40.87 76.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.927 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.16 -47.75 78.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.902 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.74 -40.21 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.136 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.18 74.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -61.35 -38.6 87.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.38 -35.45 80.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 8.6 m -69.78 -30.22 67.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.86 45.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.122 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.28 -42.12 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -38.73 92.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.892 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.71 -47.26 63.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -54.17 -39.13 66.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.9 p -69.32 -45.63 69.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.135 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -54.47 -54.24 43.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.84 -36.35 82.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.931 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 9.4 mt -57.52 -40.89 79.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 176.7 98.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.94 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 53.3 m -163.38 -42.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.989 0.423 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.3 p -134.0 89.29 2.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.138 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -167.06 -43.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -64.31 -37.26 86.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -70.78 -46.35 63.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.57 -35.91 79.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -47.97 67.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.882 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.53 -33.98 71.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.902 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -75.28 -29.73 60.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -53.38 -45.75 69.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 172.32 157.41 14.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.481 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -90.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 0.0 112.312 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -58.98 -33.22 49.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.129 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.4 m -59.32 -39.86 84.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -64.39 -51.83 61.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.99 -29.67 71.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -66.33 -67.15 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -57.99 -32.48 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -71.51 -48.32 49.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.919 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.63 -49.84 75.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.901 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.5 -57.04 10.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.12 -33.79 58.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.63 -52.85 55.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -27.83 65.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.0 m -58.61 -26.9 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -50.87 -47.44 60.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.93 -29.26 19.52 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.514 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -49.83 -43.21 48.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 0.0 110.933 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.9 ttt180 -58.03 -49.42 76.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.79 88.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.897 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.26 -49.95 72.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -42.54 81.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.77 -50.5 73.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.838 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -43.56 89.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -48.49 78.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.2 tp -57.01 -49.87 74.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.28 -48.0 71.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.43 -35.98 82.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.9 t -65.39 -32.83 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.092 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -74.5 -52.63 11.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.76 -32.58 72.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -77.98 -33.57 51.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.98 -43.29 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.537 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.4 OUTLIER -43.95 -64.93 0.67 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.59 0.709 . . . . 0.0 110.911 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.69 -30.31 22.81 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 0.0 112.371 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -58.25 -27.44 63.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -50.71 28.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -33.79 76.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.48 -48.12 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.838 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -56.59 -52.57 64.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -45.7 84.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -62.9 -22.71 66.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -72.95 -47.73 42.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -30.0 70.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -56.23 15.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.97 -34.39 71.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -69.51 -34.41 74.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 23.5 ttp -68.84 -54.29 16.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -64.29 -35.78 81.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.67 -26.06 54.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -62.81 -55.35 27.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -35.14 62.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 tt0 -68.02 -23.95 65.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -85.82 -43.85 12.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.39 -32.47 48.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.55 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 mm-40 -56.54 -65.58 1.57 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.663 0.744 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.74 -52.3 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.637 2.224 . . . . 0.0 112.357 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.24 -65.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.27 -33.95 2.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -76.22 -44.77 36.14 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.88 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -66.86 -43.52 83.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -47.13 73.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -64.99 -42.34 94.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.84 -53.08 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.26 -38.53 83.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.862 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.75 -42.02 99.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -60.21 -53.26 59.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.01 50.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -56.95 -46.03 82.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 5.1 t -59.33 -52.5 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.172 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.36 -52.37 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.845 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.38 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.134 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.19 -44.26 87.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -67.54 -43.99 79.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 23.9 m -55.84 -42.1 75.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.171 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 -33.89 30.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.13 -23.19 62.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.484 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -55.49 -62.57 4.24 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.577 0.703 . . . . 0.0 111.043 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.484 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 54.0 Cg_endo -69.72 -43.13 2.87 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.709 2.273 . . . . 0.0 112.324 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -60.9 -28.99 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 12.7 t -59.67 -51.82 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.818 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.29 -48.93 68.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.65 -51.58 68.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.06 -46.57 90.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.875 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -42.96 81.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -34.46 78.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -49.76 57.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -50.58 45.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.58 64.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.34 -34.32 55.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.118 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -48.28 81.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.6 pp -68.83 -49.18 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -50.53 73.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.87 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.59 87.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.136 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 52.7 tp -67.75 -34.85 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -31.28 66.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.23 -55.73 27.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.96 -26.27 66.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.85 39.08 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.497 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.08 -33.89 38.21 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.53 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.06 -23.83 38.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -32.53 67.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.4 pp -63.14 -36.92 85.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.886 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.54 -49.53 32.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.13 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -44.89 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.856 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -60.4 -46.82 88.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.887 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -49.23 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.898 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.89 -31.69 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.46 -49.31 16.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.68 78.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.129 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.9 m -66.32 -47.61 72.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -69.9 -36.24 75.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.44 84.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.872 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 mp -71.23 -30.13 65.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 -51.33 69.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.836 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.66 -50.37 51.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.133 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.97 -54.92 32.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 43.2 m -54.62 -35.66 63.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.827 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.56 -48.35 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.09 -27.8 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.24 -22.01 64.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.501 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 9.9 mmtt -61.21 -63.07 4.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.567 0.699 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 54.6 Cg_endo -69.69 -26.92 27.43 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.717 2.278 . . . . 0.0 112.354 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.71 -32.88 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -36.65 73.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -54.32 -50.62 66.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.48 -30.49 63.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.14 -48.41 78.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -70.39 -41.97 72.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.7 -25.76 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.955 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.461 ' O ' ' HD2' ' A' ' 220' ' ' PRO . . . -79.04 -44.49 9.8 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.73 -27.54 68.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.501 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 2.7 mp -50.85 -62.97 2.18 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 0.0 110.892 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.0 Cg_endo -69.69 -44.63 2.01 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.755 2.304 . . . . 0.0 112.328 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 90.5 t -55.88 -54.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.85 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -66.37 -40.12 89.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -48.06 83.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.872 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.91 -38.06 82.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.78 -49.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.145 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -50.75 72.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.832 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.38 -37.98 82.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.2 -40.59 97.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.28 72.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.91 -44.93 68.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.27 -38.99 88.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.6 -35.4 62.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -68.05 -48.87 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -63.74 -41.01 98.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.97 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 37.9 p -70.75 -45.88 63.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -56.22 -55.07 37.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.83 79.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 30.8 mt -57.77 -37.72 74.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.43 -30.36 69.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.3 m 73.08 -68.45 0.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.146 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.904 179.98 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.956 0.407 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 15.4 p -134.11 89.43 2.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -167.27 -43.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.9 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 6.7 p -64.57 -37.23 86.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.862 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -70.79 -46.27 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.72 -35.67 79.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -47.9 66.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.59 -34.1 71.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.868 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -75.06 -29.89 60.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.925 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -53.34 -45.87 69.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 172.34 157.4 14.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.477 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -90.25 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.649 2.233 . . . . 0.0 112.359 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -58.82 -33.22 48.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.161 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 1.4 m -59.39 -39.75 84.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.171 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -64.53 -51.86 60.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.923 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.93 -29.75 71.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.934 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -66.23 -67.01 0.48 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.899 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -32.41 68.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.95 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -71.58 -48.49 47.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.817 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -57.47 -50.0 74.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -57.01 10.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.06 -33.73 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.885 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.75 -52.85 54.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -27.8 65.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -58.6 -26.84 64.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -51.02 -47.67 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -29.26 18.86 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.528 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -49.95 -42.98 49.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -58.15 -49.47 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -44.77 88.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.908 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.21 -50.14 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.26 -42.28 81.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.856 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.88 -50.41 74.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -43.64 90.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.88 -48.87 77.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 39.1 tp -57.04 -49.49 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.955 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -54.31 -47.83 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -36.11 82.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.41 -32.7 59.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.099 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -75.09 -52.96 9.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.14 73.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -78.26 -33.83 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . 0.416 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.4 t -55.58 -47.53 78.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.139 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.558 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.4 OUTLIER -42.61 -66.23 0.45 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.619 0.723 . . . . 0.0 110.942 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.2 Cg_endo -69.77 -29.6 23.58 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.695 2.264 . . . . 0.0 112.303 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.5 t80 -58.0 -26.15 62.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.89 -49.43 17.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.932 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.15 -33.55 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.86 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -47.56 63.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -55.83 -52.94 62.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.887 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -47.28 79.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -60.37 -22.33 63.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -74.11 -48.47 29.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.871 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -31.92 73.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.6 -55.45 20.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.96 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -70.7 -34.57 72.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -69.79 -33.0 71.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 20.5 ttp -69.65 -54.4 14.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.64 -35.76 82.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -76.29 -25.98 55.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -62.92 -55.19 28.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -33.86 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.449 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 2.3 tt0 -69.37 -23.33 63.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -87.47 -44.99 10.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 58.9 t -59.9 -32.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.122 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.545 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mm-40 -57.16 -65.35 1.78 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.3 Cg_endo -69.86 -51.4 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.66 2.24 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -65.89 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.942 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.32 -34.17 1.53 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.504 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tp10 -77.14 -47.01 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 110.877 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.32 -47.69 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -51.46 63.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -60.04 -44.13 94.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.21 -52.22 50.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.95 -33.33 73.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.36 -46.42 83.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 9.7 ttp180 -58.9 -52.71 64.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.51 -54.88 42.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -57.9 -42.6 85.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 4.6 t -61.08 -51.47 72.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.27 -50.87 28.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.32 -44.65 87.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.093 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -57.93 -41.61 83.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 -67.89 -45.4 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 23.8 m -55.94 -41.23 74.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -81.54 -33.98 31.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.833 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.67 -23.38 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.483 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -55.52 -62.42 4.51 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.546 0.689 . . . . 0.0 111.123 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.3 Cg_endo -69.77 -41.29 4.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.679 2.253 . . . . 0.0 112.38 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -62.56 -29.34 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 7.7 t -59.62 -51.47 69.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.79 -49.11 69.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.95 -51.57 68.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.98 -46.68 89.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -42.62 81.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -34.65 78.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -48.8 63.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.875 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -50.59 40.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.947 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.22 -35.23 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.091 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.33 -34.31 55.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.103 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -48.28 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.904 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.6 pp -68.99 -48.86 62.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.72 -50.51 73.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.08 89.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 52.5 tp -67.68 -34.84 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -31.77 66.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -55.12 -55.59 29.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.77 -26.21 66.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.4 -33.67 40.19 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.01 -34.08 38.03 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.465 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.04 -23.79 38.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.733 0.301 . . . . 0.0 111.097 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -32.52 67.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.4 pp -63.08 -37.01 85.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.951 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.51 -49.57 31.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.053 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -44.59 90.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.62 -46.96 88.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.43 -49.22 67.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.61 70.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.078 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.49 -49.24 17.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.4 -34.89 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.1 m -65.95 -47.64 73.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.173 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -69.94 -36.23 75.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.885 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.37 84.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.33 -30.07 65.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.83 -51.24 69.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.856 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.75 -50.25 52.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.163 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.17 -54.94 32.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.869 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 43.3 m -54.53 -35.71 63.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.57 -48.31 81.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.07 -27.87 48.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.97 64.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.075 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 9.8 mmtt -61.28 -63.13 4.67 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.597 0.713 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.8 Cg_endo -69.82 -26.7 27.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.03 57.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.34 -36.48 74.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -54.34 -50.31 67.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -30.54 63.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.17 -48.32 79.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -70.42 -42.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.81 -25.59 68.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.449 ' O ' ' HD2' ' B' ' 220' ' ' PRO . . . -79.03 -44.62 9.68 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.456 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.64 -27.54 69.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.816 0.341 . . . . 0.0 110.93 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 2.6 mp -50.86 -62.92 2.23 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.593 0.711 . . . . 0.0 110.902 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.2 Cg_endo -69.81 -44.51 2.0 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.672 2.248 . . . . 0.0 112.323 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 90.3 t -55.94 -54.19 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.132 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.88 71.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.915 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -66.33 -40.08 89.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -48.05 83.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.847 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -40.19 93.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -38.07 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 53.2 t -56.71 -49.09 79.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -50.75 72.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -60.42 -37.93 82.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.24 -40.63 97.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.886 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -31.26 72.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.865 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.92 -44.98 68.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.2 -39.04 88.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.59 -35.51 62.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.96 -48.86 64.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.913 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -63.75 -41.09 98.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 38.0 p -70.69 -45.83 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.123 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -56.22 -55.06 37.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.81 79.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.74 -37.75 74.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.58 -30.23 68.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.906 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.3 m 73.14 -68.62 0.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.161 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.921 0.391 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.15 -179.79 6.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.152 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.7 p90 -159.94 39.19 0.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.59 -37.14 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.837 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -69.92 -43.59 71.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.914 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.08 -39.65 95.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -49.48 60.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.855 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -65.09 -36.45 84.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -77.74 -25.52 49.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -53.6 -43.52 68.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.917 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 126.35 79.26 0.31 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.484 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -47.12 1.0 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.696 2.264 . . . . 0.0 112.336 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.5 m -55.28 -38.01 46.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.2 m -71.83 -56.94 4.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.64 -34.96 69.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -70.01 -43.76 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.909 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -49.41 77.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.864 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -36.43 78.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.933 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -66.83 -52.45 43.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.828 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.6 -56.43 22.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.58 -34.45 74.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.929 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -56.48 -51.61 67.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -72.14 -32.12 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.6 m -65.86 -23.69 66.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.135 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.04 -32.01 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.89 -27.85 14.84 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -49.15 -34.71 14.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.79 0.329 . . . . 0.0 110.897 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -61.81 -49.88 74.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.12 -43.79 95.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.69 -49.69 74.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.18 -41.55 84.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.918 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -50.1 74.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.881 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.72 -44.29 90.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.24 -47.7 77.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 37.1 tp -57.39 -50.29 73.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.872 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -47.87 69.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.881 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -64.12 -34.86 79.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 74.4 t -65.54 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -74.71 -52.88 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.833 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.72 -33.11 73.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.119 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -77.37 -33.25 55.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.0 t -58.48 -43.93 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.143 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -43.87 -65.03 0.64 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.586 0.708 . . . . 0.0 110.897 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.75 -31.29 20.84 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.669 2.246 . . . . 0.0 112.375 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -58.18 -25.54 61.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.19 -50.17 35.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.95 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -64.36 -34.87 79.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.91 -52.39 65.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -64.49 -43.89 92.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -64.38 -22.89 67.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -49.42 34.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -29.06 69.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -56.86 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.878 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -70.99 -34.43 71.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.892 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.01 -34.3 75.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -68.89 -54.03 17.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.82 -35.58 81.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.866 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.62 -26.65 55.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -62.13 -55.24 30.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -34.01 61.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.86 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 48.2 tt0 -68.17 -23.83 64.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmtt -86.73 -44.33 11.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 55.6 t -59.0 -32.65 48.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.1 mt-10 -56.91 -65.62 1.61 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.666 0.746 . . . . 0.0 110.896 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.1 Cg_endo -69.79 -52.19 0.34 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 0.0 112.302 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.66 -64.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.19 -32.39 2.51 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.514 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -44.85 34.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.868 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -68.06 -41.91 81.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -46.25 74.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.894 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -66.49 -41.59 88.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.73 -52.86 18.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -59.54 -39.87 85.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.77 -41.15 99.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.139 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -52.63 64.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.21 45.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.123 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -56.29 -45.32 80.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.72 -52.17 64.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.088 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.03 -52.35 15.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.881 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.2 93.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.103 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.01 -44.23 87.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.3 -44.59 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 24.3 m -55.58 -42.11 74.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.125 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -81.86 -32.61 31.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.799 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -69.98 -24.51 63.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.929 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.484 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -54.38 -62.94 3.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.484 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.4 Cg_endo -69.78 -43.36 2.69 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.692 2.261 . . . . 0.0 112.348 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.4 -33.4 69.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.876 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -52.11 64.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -67.06 -31.95 72.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.881 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -66.79 -51.15 59.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.46 -49.76 76.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -36.31 72.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.853 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.82 -52.63 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.53 -47.74 77.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.84 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.1 -51.43 69.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.61 -35.79 63.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.083 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.27 50.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.066 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -48.32 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.868 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.42 -49.71 62.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -59.71 -34.09 72.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.27 -45.3 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.081 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.57 -40.97 76.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -75.61 -32.2 60.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -56.82 15.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.844 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.75 -26.33 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.905 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.29 -34.39 40.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.53 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.67 38.77 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.1 39.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.78 0.324 . . . . 0.0 111.08 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -73.56 -32.49 64.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.872 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -37.91 89.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.2 -49.92 31.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.087 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -63.87 -42.1 97.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.1 -45.27 92.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -54.47 -47.9 72.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.829 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.65 72.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -76.04 -50.6 14.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.34 93.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.119 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 83.6 m -61.43 -47.48 85.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -36.51 83.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.853 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.57 -44.66 89.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.842 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -71.85 -30.09 65.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.6 m -57.44 -51.37 69.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -51.06 50.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.197 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.33 -54.84 34.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 50.7 m -54.53 -35.23 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.09 -47.8 83.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -77.71 -30.28 51.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.22 -22.13 64.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.126 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.514 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -59.14 -63.37 4.26 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 110.904 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.514 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.75 -24.73 29.4 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.722 2.282 . . . . 0.0 112.348 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.2 -32.5 59.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.092 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.12 -35.88 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -53.85 -51.6 63.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.15 -30.85 58.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.9 tt -61.89 -51.26 68.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.949 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.48 -37.13 84.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -56.74 -48.87 76.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.877 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.416 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -67.53 -29.53 74.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.478 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.24 -32.96 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.348 . . . . 0.0 110.921 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -49.81 -61.14 3.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.644 0.735 . . . . 0.0 110.912 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.76 -39.61 6.31 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.663 2.242 . . . . 0.0 112.363 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.0 -54.73 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.21 74.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -65.85 -35.34 80.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 14.1 m -59.88 -48.19 82.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -43.1 94.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 51.6 t -55.76 -43.56 74.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.2 -50.45 73.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -61.09 -38.98 88.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.19 -33.39 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -31.43 67.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.795 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.44 -53.05 39.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.119 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.18 -43.3 87.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.941 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.3 -34.65 78.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.55 -49.34 75.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.23 -45.83 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.907 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.36 -45.95 88.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.15 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.11 -53.89 50.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -45.88 77.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 13.1 tp -56.91 -37.42 71.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 73.29 -68.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.842 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 76.19 -55.62 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.939 0.399 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.43 -179.54 6.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -159.98 39.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.0 -37.3 86.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.878 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm -69.88 -43.5 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.23 -39.54 94.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -49.51 59.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.05 -36.39 84.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -77.87 -25.39 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -53.74 -43.47 69.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.921 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 126.42 79.16 0.31 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.502 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -47.23 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.666 2.244 . . . . 0.0 112.346 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -55.11 -37.94 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.129 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 22.0 m -71.86 -57.2 4.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.129 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.909 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -70.1 -43.96 70.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -49.32 78.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -36.43 78.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.66 -52.19 47.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.835 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -61.02 -46.51 90.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.45 -56.4 22.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.8 -34.31 74.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -56.41 -51.54 67.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -72.23 -32.33 66.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.5 m -65.58 -23.54 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.153 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.22 -32.14 15.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -27.98 14.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.435 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -49.09 -34.61 14.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.314 . . . . 0.0 110.892 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -61.85 -49.96 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.854 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.16 -43.75 95.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.67 -49.62 74.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.41 -41.34 84.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.75 -44.37 90.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.1 -47.91 77.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.54 -49.88 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.924 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.46 -47.58 69.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -64.52 -34.93 79.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 71.0 t -65.52 -32.9 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.129 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -75.36 -53.3 8.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.78 74.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.117 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -77.45 -33.43 54.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . 0.412 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.3 t -55.31 -47.75 77.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.14 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.565 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -42.28 -66.49 0.41 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.609 0.719 . . . . 0.0 110.91 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.565 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.74 -30.45 22.37 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . 0.412 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.8 t80 -57.5 -25.04 59.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.907 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.42 -49.4 19.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -59.68 -34.7 73.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.874 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -47.49 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -55.99 -52.57 63.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.46 -44.62 90.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -62.71 -22.5 66.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -50.28 22.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.906 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.42 -30.58 71.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -56.44 13.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.42 -34.88 73.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -69.14 -32.52 71.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.913 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -69.8 -54.01 15.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -65.6 -35.43 80.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.18 -26.63 56.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.51 -55.07 30.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.957 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -33.36 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 48.8 tt0 -69.12 -22.78 63.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -88.39 -46.39 9.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 56.4 t -58.72 -32.59 46.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 1.0 OUTLIER -57.5 -65.53 1.74 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.616 0.722 . . . . 0.0 110.871 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.69 -51.66 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.685 2.257 . . . . 0.0 112.338 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -65.37 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.78 -32.0 2.03 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.27 -46.79 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.43 -46.34 73.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -51.96 61.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -60.32 -43.14 96.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.883 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.49 -52.01 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -59.97 -34.07 72.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.51 -45.27 87.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.115 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.852 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.25 -54.94 39.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.075 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -56.76 -43.87 81.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.862 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 4.8 t -60.21 -51.34 74.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.48 -51.49 20.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.8 90.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.115 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.08 -42.24 85.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.912 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.55 -45.63 75.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 24.2 m -55.61 -41.52 73.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.145 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -81.51 -32.89 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.25 -24.6 63.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.485 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -54.23 -62.75 3.46 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.605 0.717 . . . . 0.0 111.089 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.7 Cg_endo -69.75 -42.37 3.47 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 0.0 112.346 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -59.57 -33.68 71.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.43 -52.0 65.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -66.76 -32.34 73.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.8 -51.0 60.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -49.57 76.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -36.13 72.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -52.43 62.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.891 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.16 -47.72 78.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.861 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.41 -51.22 70.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.903 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.82 -35.45 63.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.12 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.34 50.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -47.94 60.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.85 -49.55 61.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.57 -34.21 72.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.31 -45.39 47.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.068 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.84 -40.93 76.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -75.64 -32.85 60.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.899 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -56.53 18.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.67 -26.31 60.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.855 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.45 -34.22 41.67 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.457 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.13 -33.71 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.529 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.11 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -73.54 -32.74 64.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -38.15 90.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.15 -49.71 33.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.124 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.97 -41.83 97.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.29 -45.46 91.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.33 -47.75 72.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.881 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.35 -31.55 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.084 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -76.03 -50.52 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.63 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.126 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 80.9 m -61.27 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.166 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -36.51 83.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.6 -44.55 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.01 -30.13 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 9.2 m -57.45 -51.24 70.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.835 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -51.02 50.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.137 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.44 -54.84 35.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.875 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 50.3 m -54.69 -35.09 63.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.1 -47.77 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -77.81 -30.4 51.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.883 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.19 -22.1 64.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.127 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.519 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -59.15 -63.48 4.12 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.556 0.693 . . . . 0.0 110.911 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.9 Cg_endo -69.81 -24.71 29.12 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.332 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.29 -32.29 58.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -73.19 -35.78 66.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -53.78 -51.45 63.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.914 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.16 -30.78 58.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.9 tt -61.95 -51.36 68.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.955 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.35 -37.12 84.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -56.76 -48.8 77.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.408 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -67.55 -29.41 73.98 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.5 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.27 -32.98 74.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.897 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.0 OUTLIER -49.79 -61.13 3.91 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.62 0.724 . . . . 0.0 110.931 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.73 -39.71 6.24 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.707 2.271 . . . . 0.0 112.349 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.06 -54.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.113 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.17 74.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -65.85 -35.37 80.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 14.0 m -59.86 -48.18 82.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.3 -41.94 96.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -43.15 94.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.68 -43.49 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.152 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.34 -50.33 74.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -61.13 -39.01 88.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.854 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.18 -33.4 74.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.57 -31.34 66.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.06 39.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.143 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.13 -43.23 87.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.917 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.34 -34.62 78.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.65 -49.25 75.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.18 -45.96 86.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.953 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.27 -45.97 88.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.119 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.17 -53.84 50.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -45.91 77.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 13.1 tp -56.77 -37.52 71.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 73.25 -68.67 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.16 -55.58 0.59 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.135 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.1 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.966 0.412 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.28 148.18 4.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.145 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -142.87 38.71 1.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.869 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -75.02 -43.47 53.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.905 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -34.98 70.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.2 mp -69.94 -43.34 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -71.7 -34.5 69.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.31 -49.96 15.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -64.68 -22.86 67.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.561 ' O ' ' C ' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -49.99 -18.28 0.51 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.919 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.561 ' C ' ' O ' ' A' ' 64' ' ' LEU . . . -21.99 -86.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.513 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.416 ' HG2' ' HB2' ' A' ' 69' ' ' GLN . 53.8 Cg_endo -69.73 172.91 11.75 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.759 2.306 . . . . 0.0 112.342 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.8 -49.72 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.101 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.9 m -51.2 -27.82 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.181 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.416 ' HB2' ' HG2' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -70.41 -45.76 65.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 -62.5 -42.33 99.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -63.72 -59.86 4.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.897 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -27.53 65.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.5 -52.79 35.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.87 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.19 -34.94 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -45.51 64.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.55 65.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.58 -32.04 65.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.14 -48.53 78.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.37 -45.48 31.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.124 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.57 -30.84 67.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.931 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.42 56.09 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.7 mt -58.89 -35.8 73.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -49.62 77.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -68.6 -48.21 64.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.12 -29.19 69.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.855 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.56 -51.81 13.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.0 p -65.66 -35.88 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -40.63 64.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -61.96 -48.09 81.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.67 -50.94 55.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -58.01 -42.47 85.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.89 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.45 -47.94 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.898 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.72 -33.16 39.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.114 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -52.32 10.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.87 -35.61 77.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -79.27 -34.92 42.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.417 ' HA ' ' HB2' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -53.51 -44.77 57.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.112 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.56 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -47.67 -65.96 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.58 0.705 . . . . 0.0 110.92 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.56 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.6 Cg_endo -69.71 -24.87 29.42 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.668 2.245 . . . . 0.0 112.347 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.417 ' HB2' ' HA ' ' A' ' 97' ' ' VAL . 2.7 m-30 -61.35 -35.08 76.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -51.66 16.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.943 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.05 -34.27 77.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.62 -47.32 76.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.41 -52.05 67.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -64.73 -47.52 77.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -63.99 -22.68 67.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.908 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -71.11 -48.52 51.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -23.31 57.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -64.99 -60.02 3.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.66 -34.32 73.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.42 -30.51 69.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -71.8 -53.28 13.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.87 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.29 -35.02 79.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.35 -26.19 55.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.65 -54.76 23.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.951 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.87 -33.9 66.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.417 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 22.1 tt0 -70.19 -23.09 62.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -90.3 -45.22 9.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 94.5 t -59.98 -32.45 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.139 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.539 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -57.88 -64.68 2.45 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.637 0.732 . . . . 0.0 110.901 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.4 Cg_endo -69.8 -50.94 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.679 2.253 . . . . 0.0 112.32 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -63.54 1.04 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.5 -30.47 4.49 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.496 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.52 -43.32 56.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.328 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.19 -33.96 63.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 2.6 ttt -66.99 -48.94 66.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -38.26 86.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.872 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -71.57 -52.58 17.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.8 mmt-85 -63.0 -38.2 90.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.69 88.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -64.04 -49.89 70.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.6 -38.67 70.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.043 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -66.9 -50.74 61.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . 0.418 ' CG1' ' N ' ' A' ' 157' ' ' ASP . 4.8 p -64.32 -40.62 89.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.418 ' N ' ' CG1' ' A' ' 156' ' ' VAL . 22.4 t0 -52.61 -50.56 62.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.833 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.48 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.099 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.96 -38.73 73.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -68.51 -45.57 71.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.839 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 34.7 m -55.4 -40.98 72.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.77 -34.04 30.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.02 -21.47 62.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.489 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -56.44 -62.66 4.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.61 0.719 . . . . 0.0 111.098 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.489 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.9 Cg_endo -69.74 -42.23 3.61 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.335 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -55.76 -33.68 64.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -51.58 69.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.834 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.73 -32.69 73.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.864 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -50.05 72.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.59 77.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.69 -37.74 76.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.62 -51.79 68.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.44 -38.69 81.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -41.92 75.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -45.45 75.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.25 -34.57 70.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.078 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.86 -37.5 87.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.09 -51.6 44.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -65.93 -40.64 91.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.77 -46.48 77.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -35.88 79.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.898 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -31.84 69.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.888 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -56.15 21.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.865 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.8 -25.76 63.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.53 -31.72 44.67 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.511 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -64.02 -49.88 64.35 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.46 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.68 -21.83 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.322 . . . . 0.0 111.127 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -71.76 -29.11 64.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -49.91 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.914 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.45 -48.95 68.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.115 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -63.37 -51.45 65.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.903 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -54.11 -48.93 70.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.91 69.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.68 -42.4 41.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.922 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.94 -47.7 73.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.137 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 40.0 p -60.07 -46.82 88.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.187 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.88 -35.86 75.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.12 -54.27 46.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -28.7 64.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.53 -51.41 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.817 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -50.85 30.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.71 -57.34 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -54.46 -35.96 63.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.99 -47.84 81.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -27.75 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.31 66.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.524 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.0 OUTLIER -64.61 -63.99 3.17 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.581 0.705 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.524 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.4 Cg_endo -69.77 -26.85 27.13 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.724 2.283 . . . . 0.0 112.298 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.73 -31.75 59.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 5.7 tt -71.2 -40.83 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.65 -51.16 66.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -75.99 -29.81 58.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.851 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -45.78 91.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -72.92 -40.03 65.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.841 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -68.06 -25.12 65.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.471 ' O ' ' HD2' ' A' ' 220' ' ' PRO . . . -80.7 -49.84 5.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -27.99 69.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.846 0.355 . . . . 0.0 110.925 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.515 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -50.51 -63.43 1.85 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.596 0.712 . . . . 0.0 110.948 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.2 Cg_endo -69.74 -46.44 1.23 Allowed 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.709 2.272 . . . . 0.0 112.363 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 94.0 t -54.59 -55.09 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.187 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.06 -31.71 70.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.937 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -69.11 -36.28 77.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.58 83.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.22 -44.22 97.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -40.25 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 38.9 t -55.38 -48.39 76.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.102 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 2.3 t -59.02 -50.11 75.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.831 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.09 -35.22 79.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.859 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.09 -34.24 77.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.908 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 67.4 m -73.56 -31.4 63.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.55 57.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.113 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.7 pp -64.9 -37.93 89.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.5 -34.97 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.36 -49.9 57.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -58.93 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.905 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 35.1 m -67.88 -39.81 83.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.145 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.63 -54.17 49.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -48.99 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.945 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.06 -33.47 69.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.96 -22.07 31.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.63 -68.79 0.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.92 179.971 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.924 0.392 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.45 148.12 4.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.11 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -142.8 38.87 1.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.88 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -75.11 -43.49 52.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.894 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.58 -34.94 70.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.885 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 8.2 mp -69.86 -43.46 71.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.937 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -71.67 -34.44 69.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -76.35 -49.99 15.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.86 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -64.71 -22.97 67.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.568 ' O ' ' C ' ' B' ' 65' ' ' GLY . 0.2 OUTLIER -49.93 -18.32 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.898 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . 0.568 ' C ' ' O ' ' B' ' 64' ' ' LEU . . . -21.87 -86.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.487 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.401 ' HG2' ' HB2' ' B' ' 69' ' ' GLN . 53.5 Cg_endo -69.77 172.96 11.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.691 2.261 . . . . 0.0 112.34 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 21.3 m -75.78 -49.66 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.11 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 11.9 m -51.3 -27.82 10.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.13 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . 0.401 ' HB2' ' HG2' ' B' ' 66' ' ' PRO . 0.3 OUTLIER -70.38 -45.75 65.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 -62.55 -42.24 99.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.8 -59.78 4.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -27.47 65.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.44 -52.84 34.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.857 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.16 -34.85 78.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.02 -45.42 63.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.0 -33.58 65.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.48 -32.13 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.1 -48.56 78.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -45.49 31.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.118 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.55 -30.98 67.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.878 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.38 -33.49 56.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.85 -35.78 73.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.794 0.331 . . . . 0.0 110.9 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -49.73 76.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -68.49 -48.0 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.34 -29.1 69.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.53 -51.6 14.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.912 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 19.1 p -65.93 -35.9 81.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.862 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -40.61 64.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.15 -48.58 79.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.3 -50.75 59.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -57.78 -42.79 84.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.88 -45.05 60.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 4.0 t -59.59 -33.93 53.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.134 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -53.91 7.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.87 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.124 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.8 tptt -79.14 -35.89 41.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.898 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -50.69 -47.64 28.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.113 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.595 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -45.73 -68.07 0.33 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.576 0.703 . . . . 0.0 110.941 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.4 Cg_endo -69.74 -18.11 37.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.696 2.264 . . . . 0.0 112.35 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -66.18 -34.36 77.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.96 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -50.81 11.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.49 -35.52 74.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.93 -46.84 73.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -52.24 66.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.44 -47.93 74.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -62.52 -22.51 66.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -72.31 -48.42 42.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -24.98 59.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.888 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.17 -60.8 2.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.47 -34.59 77.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -69.19 -30.43 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.885 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -70.37 -53.67 15.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -66.68 -35.03 79.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.06 -26.21 56.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.888 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -65.56 -54.94 20.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -73.12 -33.56 65.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.427 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 22.6 tt0 -70.45 -22.56 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.927 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -91.13 -45.61 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.26 -32.77 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.155 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -58.04 -64.54 2.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.644 0.735 . . . . 0.0 110.892 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.1 Cg_endo -69.76 -50.29 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.685 2.257 . . . . 0.0 112.319 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -64.09 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.876 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.43 3.74 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.493 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -75.37 -45.39 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.822 0.344 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.72 -35.93 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 1.8 ttt -66.66 -54.04 27.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.877 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -39.3 93.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -68.83 -52.68 27.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 7.4 mmt-85 -63.63 -32.26 73.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.31 -42.89 92.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.082 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -62.18 -46.54 88.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.22 69.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.08 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -66.76 -50.67 61.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.8 p -63.49 -40.02 87.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.168 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -52.84 -50.32 63.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.73 -48.96 67.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.145 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.39 -38.07 73.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 20.7 tpp85 -68.61 -45.15 72.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 34.8 m -55.8 -40.83 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.94 -34.07 29.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.836 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.33 -21.63 62.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.483 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -56.15 -62.39 4.85 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 0.0 111.092 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 54.1 Cg_endo -69.71 -41.56 4.23 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.724 2.282 . . . . 0.0 112.367 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.51 -34.22 66.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.955 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.15 -51.45 69.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.69 -32.91 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -50.06 71.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.9 -37.96 77.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -51.66 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.937 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -39.34 81.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.867 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -41.59 77.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.15 75.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.87 71.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.77 -36.97 86.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.817 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.59 -51.37 43.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.897 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.45 -42.19 92.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.945 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.19 77.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.084 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -35.35 77.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -31.51 70.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.952 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -55.85 24.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.81 -25.82 63.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.54 -31.97 45.17 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.464 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -63.83 -49.9 64.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.495 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.86 -21.65 43.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.071 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -71.89 -29.11 64.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -49.9 75.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.39 -49.02 68.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.114 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.22 -34.2 76.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.867 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.2 -51.56 65.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.917 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -54.02 -48.8 70.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.835 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.82 69.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.123 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.73 -42.34 41.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.71 73.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 39.9 p -60.12 -46.82 88.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.084 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.87 -35.83 75.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.21 -54.32 45.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.821 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.07 -28.71 64.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.54 -51.27 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.81 30.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.117 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.84 -57.28 11.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.5 m -54.43 -35.98 63.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.97 -47.81 81.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.81 -27.78 44.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.46 -23.35 66.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.151 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.523 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.0 OUTLIER -64.47 -64.01 3.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.574 0.702 . . . . 0.0 110.923 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -26.89 27.36 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 0.0 112.331 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.68 -31.69 59.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.099 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 5.6 tt -71.13 -40.97 71.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.57 -51.12 66.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.903 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.94 -29.87 58.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.02 -45.69 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.91 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -73.01 -39.83 65.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.23 -25.07 65.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.474 ' O ' ' HD2' ' B' ' 220' ' ' PRO . . . -80.69 -49.94 5.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.472 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -28.01 69.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.866 0.365 . . . . 0.0 110.896 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.513 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.4 mp -50.45 -63.44 1.84 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.615 0.721 . . . . 0.0 110.921 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.82 -46.51 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.662 2.242 . . . . 0.0 112.338 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 91.9 t -54.56 -55.08 17.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.124 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.08 -31.79 70.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.896 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -69.1 -36.17 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -47.65 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.24 -44.18 97.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.864 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -40.33 95.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.39 -48.34 77.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.085 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 2.2 t -59.07 -50.06 75.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -35.33 79.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.1 -34.14 77.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 67.3 m -73.62 -31.41 63.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.57 56.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.077 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.7 pp -64.92 -37.95 89.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.41 -34.93 68.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.92 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.38 -50.01 56.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -58.87 -47.1 86.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.3 m -67.9 -39.86 83.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.61 -54.18 48.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -48.98 77.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 58.9 tp -58.08 -33.52 69.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.889 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.83 -22.14 31.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.873 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.64 -68.77 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.908 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.941 0.4 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -148.12 172.31 14.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.106 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -90.67 47.79 1.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 t -64.34 -37.67 88.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.838 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.3 tptm -76.41 -46.47 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -38.68 91.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.931 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -45.32 62.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -42.46 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.848 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -78.06 -22.33 49.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -38.88 69.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.959 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -52.19 177.43 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.463 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -4.79 14.73 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.288 . . . . 0.0 112.33 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 m -64.44 -28.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.148 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -43.98 -33.74 1.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.154 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -58.23 -50.03 75.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -72.53 -27.54 62.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -62.91 -55.15 28.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -71.02 -34.78 71.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.939 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.31 -53.71 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 -65.21 -39.21 92.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.82 -54.91 39.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.58 -36.09 77.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -50.73 70.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.06 -31.44 61.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -22.07 60.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.149 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.58 -34.18 17.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.84 -27.04 19.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.476 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.36 -35.65 12.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.789 0.328 . . . . 0.0 110.93 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -60.27 -50.21 74.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -45.08 96.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -49.06 73.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.13 -40.78 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -50.66 73.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.78 -46.27 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -55.6 -46.15 77.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -57.48 -50.24 73.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -48.58 69.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.21 -36.68 84.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 70.5 t -64.99 -32.03 56.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -73.92 -52.64 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.85 -33.66 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.103 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -77.89 -32.85 52.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.0 t -58.35 -43.59 86.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.178 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 mm-40 -43.59 -65.21 0.61 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.701 . . . . 0.0 110.866 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.74 -32.15 19.24 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.712 2.274 . . . . 0.0 112.306 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -58.58 -25.02 62.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.929 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.58 -51.07 25.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -33.0 74.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.872 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -47.54 68.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.825 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.91 -52.46 64.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -64.58 -47.27 79.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.914 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -60.31 -22.96 63.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -74.71 -46.87 34.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.942 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -29.79 70.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -68.64 -54.61 15.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.896 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -35.12 73.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.849 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -70.41 -30.48 67.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -71.43 -53.26 14.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.916 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.36 -35.03 79.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.8 tp -76.15 -26.12 55.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.48 -54.18 26.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.951 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -72.96 -34.05 66.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 43.1 tt0 -70.34 -23.79 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.93 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -89.04 -45.05 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.87 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 99.5 t -61.33 -32.12 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.538 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.3 OUTLIER -56.22 -64.69 2.1 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.626 0.727 . . . . 0.0 110.845 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.5 Cg_endo -69.76 -52.02 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.693 2.262 . . . . 0.0 112.326 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -63.02 1.2 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.57 -32.38 2.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.458 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.31 -44.09 47.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.354 . . . . 0.0 110.927 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.56 -36.86 73.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -48.33 66.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.916 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -68.82 -37.75 79.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.2 -52.86 16.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -62.42 -41.37 98.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.64 -39.87 92.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.092 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -62.23 -53.12 59.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.12 61.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -60.58 -45.16 94.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.83 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.11 -53.72 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.37 -52.64 20.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.4 96.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.54 -41.89 86.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.941 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -65.54 -48.26 73.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 21.3 m -55.56 -42.46 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.129 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.88 -32.44 51.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.15 -19.63 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.472 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -59.68 -62.38 6.0 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.607 0.718 . . . . 0.0 111.121 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 53.1 Cg_endo -69.86 -47.12 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 0.0 112.327 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -55.92 -27.44 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -51.35 64.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.846 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.32 -34.51 78.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -51.96 21.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.932 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 8.8 mp -61.14 -49.45 77.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.913 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -61.22 -33.71 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -52.33 64.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.61 -43.1 69.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.97 -50.63 72.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.76 -32.81 74.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.25 -42.02 60.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.068 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -73.77 -32.09 63.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.69 -49.54 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.948 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.23 -35.59 71.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.02 -47.89 60.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.16 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.55 -43.32 93.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -32.43 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -51.03 68.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.92 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -69.08 -26.32 64.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.56 42.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.453 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.43 -31.9 36.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.462 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.47 -25.62 41.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -38.23 64.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -37.26 80.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.957 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.24 -48.78 40.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -47.99 81.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.29 -44.04 95.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.896 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.08 -47.44 71.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.861 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.49 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -76.07 -51.31 12.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.845 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.63 -45.66 78.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 95.3 m -59.59 -46.86 87.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.66 -38.65 91.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.59 -40.62 83.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.865 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -32.08 65.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.891 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.79 -50.99 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.854 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.29 -51.27 59.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.186 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.77 -50.23 68.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.82 -35.23 68.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.72 -47.81 84.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -31.75 56.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.34 63.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.085 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.5 OUTLIER -60.41 -63.12 4.66 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.601 0.715 . . . . 0.0 110.916 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.73 -27.65 26.37 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.68 2.254 . . . . 0.0 112.364 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.41 -31.82 58.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.29 -36.39 68.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.84 -50.91 65.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -73.68 -34.0 64.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.6 tt -61.46 -49.29 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.93 -36.1 83.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -57.03 -48.79 77.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.412 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -67.6 -29.52 74.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.438 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.19 -32.51 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.921 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.46 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.4 OUTLIER -49.42 -60.79 4.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.602 0.715 . . . . 0.0 110.947 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.82 -39.01 6.89 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.679 2.253 . . . . 0.0 112.333 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.17 -55.33 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 -34.42 73.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.58 -34.78 78.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -48.32 82.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.17 -42.5 79.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -63.08 -46.58 86.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 40.1 t -56.89 -39.91 68.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.129 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 28.7 m -58.67 -50.26 74.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -61.25 -36.76 80.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.912 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.71 -34.39 77.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -30.82 66.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.31 -51.37 53.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.111 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.56 -44.79 77.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.867 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -35.81 79.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.13 -48.9 66.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -54.16 -40.72 67.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.1 m -73.09 -40.23 65.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.097 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.54 -54.83 39.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -37.41 78.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 2.3 tp -57.68 -38.16 74.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -172.99 87.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 1.5 m -51.39 128.83 23.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.148 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.888 -179.975 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.958 0.408 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 61.3 p -148.23 172.27 14.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -90.67 47.69 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.4 t -64.09 -37.7 88.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 tptm -76.4 -46.4 27.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -38.67 91.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.891 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -45.42 62.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.57 -42.42 92.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.904 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.98 -22.41 49.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.913 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -39.0 69.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -52.17 177.48 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.491 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 -4.83 14.79 Favored 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.721 2.281 . . . . 0.0 112.367 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 m -64.36 -28.56 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.01 -33.68 1.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.138 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -58.21 -50.08 74.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.924 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -72.5 -27.66 62.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -62.79 -55.12 29.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -71.08 -34.68 71.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.26 -53.82 26.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -65.1 -39.36 93.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.65 -54.92 39.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.75 -35.97 77.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.46 -50.69 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.887 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.12 -31.4 61.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.92 -22.07 59.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.145 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.7 -34.25 18.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.89 -27.09 20.0 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 pp -48.46 -35.58 13.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 0.0 110.903 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 64.6 ttt-85 -60.3 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -45.04 96.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.89 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.08 73.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.27 -40.62 86.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.94 -50.62 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.95 -46.43 88.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -55.38 -46.4 76.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 60.6 mt -57.46 -50.1 74.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -48.62 69.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.41 -36.58 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.901 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.12 -32.07 56.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.16 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -74.38 -53.07 10.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.921 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.0 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -78.22 -33.05 50.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . 0.418 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.4 t -55.13 -46.79 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.568 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.6 mm-40 -42.75 -66.52 0.42 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.663 0.744 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.568 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.78 -31.54 20.24 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.698 2.265 . . . . 0.0 112.305 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . 0.418 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 12.7 t80 -58.17 -24.19 58.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.52 -50.02 16.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.914 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -33.04 70.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.86 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -46.76 65.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -53.42 56.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -63.51 -47.72 80.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.937 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -61.06 -22.21 64.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -72.74 -48.08 41.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -63.4 -31.41 72.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.8 -55.82 20.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.1 -34.44 71.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.39 -32.75 70.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -53.45 18.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.4 -35.84 82.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.908 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -76.22 -25.96 55.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.877 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.68 -54.62 25.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -73.47 -33.59 64.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.867 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.421 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 44.0 tt0 -70.36 -23.05 62.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -90.83 -45.17 8.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.905 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 87.6 t -60.8 -32.46 52.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.532 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.2 OUTLIER -58.15 -64.47 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.648 0.737 . . . . 0.0 110.864 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.532 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 54.2 Cg_endo -69.75 -50.41 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.712 2.275 . . . . 0.0 112.362 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -64.74 0.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.65 -31.96 2.75 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.496 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.1 -46.06 30.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.877 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.15 -41.0 77.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -52.21 58.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -64.43 -37.36 87.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.847 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.55 -51.81 46.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -64.59 -35.19 80.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.63 88.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.065 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -60.04 -52.53 64.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -55.5 -54.54 42.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -61.52 -40.47 94.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.03 -52.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -51.26 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.26 -45.61 93.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.073 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -40.21 81.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.937 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -66.15 -47.83 72.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 21.4 m -56.14 -42.64 77.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.132 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.37 -32.84 55.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.48 -19.22 62.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.47 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -60.02 -62.08 6.61 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.535 0.683 . . . . 0.0 111.043 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.5 Cg_endo -69.81 -46.52 1.18 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.669 2.246 . . . . 0.0 112.312 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -56.68 -27.79 59.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.1 66.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.815 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -52.03 20.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 8.9 mp -61.04 -49.17 78.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -61.46 -33.72 74.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.874 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.66 -52.16 65.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.892 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.16 -43.57 70.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.4 tp -60.82 -50.46 73.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.9 -32.87 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.97 60.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.101 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -73.84 -31.95 63.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.867 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.48 -48.74 66.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.11 -38.88 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -67.03 -46.96 72.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -60.85 -42.18 97.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.926 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -33.07 67.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -50.54 69.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -69.09 -26.39 64.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.43 -34.55 42.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.9 36.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.35 -25.76 42.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.809 0.338 . . . . 0.0 111.11 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -38.31 64.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -37.27 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.16 -48.79 40.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -47.74 82.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.49 -43.96 96.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.947 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.13 -47.51 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.841 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.15 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -76.01 -51.25 12.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.73 -45.7 77.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.071 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 94.9 m -59.58 -46.79 87.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.132 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -63.75 -38.6 91.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.848 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -58.62 -40.66 83.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.94 -32.0 64.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -50.97 71.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.34 -51.24 59.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.184 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.82 -50.2 69.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.89 -35.26 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.65 -47.84 84.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -31.86 56.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.24 63.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.12 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.5 OUTLIER -60.55 -63.18 4.6 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 0.0 110.892 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -27.74 26.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.676 2.251 . . . . 0.0 112.365 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.37 -31.77 58.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.088 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.21 -36.28 69.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.81 -50.86 65.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.53 -34.2 65.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.824 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.38 -49.36 77.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.78 -36.16 83.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.84 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -57.03 -48.82 77.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.916 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.411 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -67.54 -29.46 74.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.508 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.25 -32.56 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.331 . . . . 0.0 110.883 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.469 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.4 OUTLIER -49.38 -60.86 4.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.597 0.713 . . . . 0.0 110.927 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 54.1 Cg_endo -69.69 -39.08 7.09 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.717 2.278 . . . . 0.0 112.383 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.21 -55.31 23.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.136 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -34.38 73.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.63 -34.74 78.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -48.34 82.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.866 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.13 -42.62 79.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.08 -46.53 86.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 39.8 t -56.88 -39.92 68.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.142 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 28.5 m -58.73 -50.21 74.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.874 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.26 -36.77 80.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.72 -34.31 77.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.55 -30.78 66.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.28 53.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.073 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.61 -44.75 77.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -35.73 79.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -67.2 -48.91 66.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.838 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -54.22 -40.7 67.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 96.9 m -73.07 -40.24 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.153 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.61 -54.75 40.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.903 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.06 -37.35 78.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 2.2 tp -57.58 -38.24 74.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.869 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -172.92 87.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 1.5 m -51.48 128.79 23.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.156 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 179.989 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.8 m . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.7 t -71.98 -35.76 69.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.164 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -118.94 37.07 4.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -42.67 63.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.848 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -69.8 -41.04 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -45.49 93.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.908 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -65.85 -47.12 76.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.878 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -57.54 -43.2 84.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -77.51 -24.37 50.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -53.98 -41.66 68.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.98 73.48 0.97 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.459 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -32.13 19.12 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.659 2.239 . . . . 0.0 112.336 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.0 m -55.59 -33.36 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.5 p -67.49 -47.34 70.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.098 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -54.8 -47.91 73.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.899 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.7 -30.42 69.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -59.28 5.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.902 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -68.4 -44.14 75.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -56.46 -49.53 74.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.85 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -63.02 -46.43 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -56.5 21.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.918 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.06 -34.9 72.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -56.59 -51.33 69.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -32.07 65.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.21 -24.75 67.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.158 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -50.91 -33.13 22.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.03 -26.84 9.24 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.508 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -47.4 -40.7 18.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -59.44 -49.83 76.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.12 -47.39 85.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.75 -49.69 67.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -40.37 82.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -59.88 -50.78 72.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.7 -46.21 87.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -55.47 -47.66 75.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.83 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -48.1 80.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.55 -47.57 76.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -36.58 83.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.58 -31.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.162 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -52.75 10.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.83 -33.71 75.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -77.35 -33.51 55.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 1.4 t -59.5 -42.15 87.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.103 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.536 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.1 OUTLIER -44.92 -64.73 0.78 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.611 0.72 . . . . 0.0 110.918 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.78 -31.52 20.25 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.679 2.253 . . . . 0.0 112.34 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.402 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 16.4 t80 -60.78 -24.88 66.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.937 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.23 -50.8 24.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.945 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -65.66 -34.24 77.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.858 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -47.32 77.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -52.26 66.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.84 -46.9 82.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.25 -22.58 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.902 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -71.46 -45.54 62.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.887 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -25.67 61.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.936 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -65.47 -59.53 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -67.83 -34.31 76.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.2 -31.46 68.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.916 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -68.41 -54.11 19.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.87 -34.74 78.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.929 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.74 -26.19 54.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.94 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -64.35 -54.57 30.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -33.28 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -71.34 -24.92 62.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -87.18 -47.07 9.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.89 -31.27 49.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.158 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.537 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 3.7 mt-10 -54.74 -64.7 1.77 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.583 0.706 . . . . 0.0 110.838 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.7 Cg_endo -69.77 -54.96 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.41 -62.48 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.01 -31.52 4.32 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.83 -42.77 57.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.796 0.331 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.19 -35.26 66.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 16.6 mtp -67.1 -48.92 66.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -37.54 79.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.841 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -71.0 -52.05 21.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -63.28 -35.65 81.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.935 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.77 -41.25 96.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.063 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -62.76 -47.97 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.08 -32.57 67.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -69.67 -50.43 44.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.26 -41.2 88.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.127 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -53.39 -52.86 57.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.37 -48.36 75.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.2 -38.55 73.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -44.08 78.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.61 -42.99 79.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -80.95 -29.77 35.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 34.8 tp -70.69 -18.2 62.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' ALA . . . . . 0.488 ' CB ' ' CD ' ' A' ' 165' ' ' PRO . . . -59.95 -63.11 4.63 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.572 0.701 . . . . 0.0 111.106 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' A' ' 164' ' ' ALA . 54.3 Cg_endo -69.71 -44.88 1.85 Allowed 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.722 2.281 . . . . 0.0 112.356 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.907 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.6 -49.18 72.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.17 -46.66 87.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.3 -52.33 54.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 17.8 tp -58.59 -47.69 83.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 8.7 mmp_? -56.56 -38.31 71.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.929 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.62 -49.14 77.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -61.03 -47.72 85.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.917 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.92 -46.01 89.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -36.22 65.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.22 -34.7 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -33.6 76.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 8.9 tt -73.61 -49.39 26.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -50.3 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.68 73.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.108 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.02 -35.83 79.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -65.25 -27.8 68.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.4 -56.6 15.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.58 -48.36 77.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -56.05 -32.28 59.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.493 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.46 71.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.25 -54.24 7.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 0.0 111.121 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -55.75 -28.62 56.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 11.4 tp -56.09 -47.32 78.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.56 58.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.08 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -60.32 -34.16 73.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.51 -47.25 79.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.91 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.51 -47.63 72.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.55 -30.71 71.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.12 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -49.67 20.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.34 87.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.116 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.02 -47.03 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.72 -39.49 91.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.85 -38.03 77.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -34.17 65.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.948 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.4 m -57.15 -50.74 71.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.819 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.37 -51.43 60.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.143 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.53 -47.76 72.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.914 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 24.6 p -59.33 -33.71 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.801 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.57 -46.97 88.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.56 -32.26 58.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.6 -20.35 63.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.498 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -59.85 -62.82 5.12 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.593 0.711 . . . . 0.0 110.929 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.77 -27.34 26.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.693 2.262 . . . . 0.0 112.352 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.62 -35.59 60.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.126 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.75 -34.87 74.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.954 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -51.05 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -71.25 -34.65 70.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.88 -50.34 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -36.35 83.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -56.81 -48.56 77.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.954 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . 0.418 ' C ' ' HD2' ' A' ' 220' ' ' PRO . . . -66.64 -29.26 74.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.51 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.03 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.6 OUTLIER -48.77 -60.73 4.13 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.627 0.727 . . . . 0.0 110.938 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' PRO . . . . . 0.466 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.9 Cg_endo -69.75 -38.56 7.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.68 2.253 . . . . 0.0 112.367 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 48.0 t -58.17 -54.22 35.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -35.0 74.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.91 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.49 -37.29 86.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' SER . . . . . 0.418 ' O ' HG23 ' A' ' 227' ' ' VAL . 1.5 m -60.32 -45.81 92.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.5 -36.46 68.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.64 -51.78 56.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 224' ' ' SER . 30.0 m -57.62 -35.97 52.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.106 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.7 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.48 -33.71 76.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -31.45 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.79 -51.7 52.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.9 -46.08 72.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.935 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.47 -36.22 75.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.22 -48.78 72.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -54.04 -39.84 66.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.939 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 78.5 m -65.58 -46.45 79.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -55.07 37.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.867 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -44.85 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.78 -35.03 68.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 74.73 61.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.907 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 39.21 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.942 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.958 0.408 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 9.7 t -71.98 -35.8 69.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.101 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -119.06 37.56 4.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.855 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.68 -42.64 64.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -69.94 -41.42 74.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.88 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.84 -45.89 91.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -65.66 -47.3 75.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -57.14 -43.43 82.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -77.51 -24.11 50.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.91 -41.1 67.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.96 73.24 0.96 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.482 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -32.08 19.42 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.705 2.27 . . . . 0.0 112.348 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 25.2 m -55.37 -35.8 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 16.6 p -66.1 -42.23 89.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -58.02 -52.77 64.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.54 -28.9 69.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -62.61 1.75 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.892 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 25.6 p-90 -67.46 -32.84 73.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.48 -52.03 60.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.864 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -63.28 -43.39 98.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.898 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -56.84 16.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.15 -34.96 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -56.65 -51.32 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -32.21 66.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -62.02 -24.86 67.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.12 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -51.06 -33.33 25.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.817 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.15 -26.93 9.71 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.437 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -47.38 -40.54 17.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.911 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -59.58 -49.77 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.26 -47.26 86.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.81 -49.7 67.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -40.05 81.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.878 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 51.4 m -60.08 -50.59 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.83 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.89 -46.28 88.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -55.29 -47.92 74.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.895 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.55 -47.58 81.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.64 -47.45 76.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 -36.65 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 78.2 t -66.54 -31.23 52.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -53.02 9.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.43 -34.74 75.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -77.86 -33.96 51.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' VAL . . . . . 0.42 ' HA ' ' HB3' ' B' ' 100' ' ' TYR . 1.0 OUTLIER -56.02 -45.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.149 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.559 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.2 OUTLIER -44.08 -66.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.592 0.71 . . . . 0.0 110.952 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.559 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.81 -30.48 21.99 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.668 2.245 . . . . 0.0 112.313 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . 0.42 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.4 t80 -60.89 -24.07 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -76.33 -50.6 13.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -60.99 -34.66 75.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -47.22 72.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -52.4 65.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.96 -47.59 79.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.06 -22.11 66.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 23.2 tptt -72.34 -46.49 55.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.856 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -26.41 63.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -65.98 -59.98 3.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.83 -34.56 78.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.34 -30.42 67.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -68.81 -54.13 17.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -66.65 -34.45 77.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.71 -26.1 54.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -65.85 -54.2 29.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 -33.35 65.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.833 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.408 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 56.6 tt0 -71.57 -24.12 61.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -88.47 -48.68 7.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.906 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.88 -31.54 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.088 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.7 mt-10 -55.59 -64.64 2.01 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.628 0.728 . . . . 0.0 110.88 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.7 Cg_endo -69.81 -52.73 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.71 2.274 . . . . 0.0 112.304 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.47 -63.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.74 -31.25 2.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -77.59 -45.78 24.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 0.0 110.893 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -68.7 -46.64 68.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.94 -51.82 65.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -60.52 -42.14 95.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -66.46 -51.4 57.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -60.86 -32.08 71.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.76 -47.83 76.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -58.81 -45.82 89.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.868 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.3 -33.52 67.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.09 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -69.0 -50.36 49.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.17 -41.13 90.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -53.26 -52.68 58.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -48.73 73.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.076 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.16 -37.92 72.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -44.24 77.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.849 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.71 -42.41 79.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -81.43 -29.77 33.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 35.1 tp -70.86 -18.29 62.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.949 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' ALA . . . . . 0.482 ' CB ' ' CD ' ' B' ' 165' ' ' PRO . . . -59.69 -62.96 4.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.589 0.709 . . . . 0.0 111.123 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.79 -44.0 2.31 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.703 2.269 . . . . 0.0 112.35 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -58.41 -27.76 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 1.1 m -64.19 -48.74 74.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -62.1 -47.28 85.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.872 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.09 -52.26 56.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 17.0 tp -58.47 -48.32 81.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 8.8 mmp_? -56.5 -37.33 70.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -45.34 91.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.89 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -63.73 -47.58 80.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.842 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.28 -43.58 94.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.22 -36.99 69.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.94 -34.62 64.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.135 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -33.57 76.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 9.0 tt -73.49 -48.98 29.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.939 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.59 56.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.86 -49.45 73.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.64 -36.11 81.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.2 -27.73 68.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.922 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.48 -56.29 18.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.66 -46.84 83.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.906 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -57.43 -32.45 64.36 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.7 71.55 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.537 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.14 -54.11 7.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -55.77 -28.57 56.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.97 -47.77 77.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.911 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.66 -48.56 59.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.25 -34.09 73.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.934 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -64.48 -47.28 79.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.923 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.5 -47.85 72.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.86 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.33 -30.71 71.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.064 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -49.76 20.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.07 -39.19 86.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.0 -46.99 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.124 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.99 -39.25 90.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.93 -38.04 78.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.21 -34.22 65.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.946 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 8.4 m -57.1 -50.67 72.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.44 -51.35 60.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.118 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -47.86 72.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.969 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 24.3 p -59.35 -33.53 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.58 -47.01 88.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.915 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -32.41 58.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.49 -20.25 63.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.51 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -60.0 -62.92 4.92 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.589 0.709 . . . . 0.0 110.888 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' PRO . . . . . 0.51 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.2 Cg_endo -69.77 -27.13 26.79 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.717 2.278 . . . . 0.0 112.347 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.81 -35.65 59.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.121 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 18.4 mt -69.66 -34.7 74.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.941 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.47 -50.94 64.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -71.21 -34.79 71.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.72 -50.53 73.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -36.31 83.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -56.76 -48.6 77.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' B' ' 220' ' ' PRO . . . -66.59 -29.24 74.44 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.526 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 7.9 tp -66.08 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 219' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.6 OUTLIER -48.7 -60.77 4.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 220' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.78 -38.58 7.56 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.677 2.251 . . . . 0.0 112.339 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 221' ' ' VAL . . . . . . . . . . . . . 47.7 t -58.09 -54.28 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -35.12 74.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 223' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.35 -37.17 86.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.921 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 224' ' ' SER . . . . . 0.429 ' O ' HG23 ' B' ' 227' ' ' VAL . 1.5 m -60.51 -45.81 92.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.45 -36.47 68.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.61 -51.76 57.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 227' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 224' ' ' SER . 30.9 m -57.6 -35.97 52.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.151 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -51.38 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.72 -38.12 89.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.932 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 230' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.53 -33.68 76.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -31.37 67.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.81 -51.65 53.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 233' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.97 -46.09 72.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.4 -36.36 75.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.12 -48.76 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -53.98 -39.88 66.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 78.3 m -65.6 -46.41 79.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.142 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -55.08 36.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.865 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -44.83 80.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.895 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.74 -35.03 68.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 74.78 60.93 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.13 39.01 3.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.121 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.905 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.841 0.353 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -57.5 11.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -58.03 -35.21 70.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.922 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -58.62 -52.07 67.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.94 -32.83 63.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.887 HG22 HD23 ' A' ' 82' ' ' LEU . 95.0 m -62.14 -25.96 68.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.168 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.76 -34.38 27.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.91 -27.76 14.61 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.441 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.887 HD23 HG22 ' A' ' 79' ' ' THR . 2.3 pp -48.62 -37.31 17.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.831 0.348 . . . . 0.0 110.921 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -59.65 -44.71 93.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.93 -49.61 73.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 6.4 mtp -58.16 -41.56 84.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.75 -50.61 73.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.58 -44.34 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.71 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER -56.5 -47.41 79.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.45 -49.67 75.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -54.34 -47.8 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.06 -34.92 79.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.94 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 89' ' ' ASP . 69.3 t -66.41 -32.3 57.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.14 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -74.93 -52.91 10.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.54 -33.65 75.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -77.53 -33.42 54.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -58.67 -43.07 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.136 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 5.6 mm-40 -44.38 -65.05 0.66 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.586 0.708 . . . . 0.0 110.908 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.4 Cg_endo -69.77 -32.27 18.85 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.672 2.248 . . . . 0.0 112.332 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 14.7 t80 -58.94 -25.26 63.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.9 mt -72.5 -50.64 24.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.59 -34.17 77.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -47.74 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.69 -52.22 65.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.74 -45.59 85.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -63.2 -22.61 66.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -73.25 -47.15 45.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -28.41 68.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -66.27 -56.46 11.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -70.28 -34.63 73.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.44 -32.53 71.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -69.2 -54.2 16.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -35.03 79.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.869 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.64 -26.25 54.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.76 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.0 t80 -63.33 -55.35 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -73.61 -36.02 65.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.851 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 72.6 tp60 -67.93 -22.56 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -89.07 -36.23 15.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 115' ' ' TYR . 85.5 t -64.86 -32.55 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.9 tt0 -59.56 -61.83 7.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.651 0.739 . . . . 0.0 110.859 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.6 Cg_endo -69.7 -52.32 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.677 2.251 . . . . 0.0 112.395 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 28.4 tp -69.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.89 -32.42 2.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.67 -44.66 32.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.814 0.34 . . . . 0.0 110.916 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.71 -42.63 81.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 35.4 mmt -66.82 -47.47 71.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.41 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.3 tpp85 -64.53 -42.94 95.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.8 -52.77 22.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -59.99 -34.9 73.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.844 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.34 -41.67 96.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.099 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -63.27 -48.27 78.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.03 71.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.101 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -69.31 -50.69 44.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.1 p -66.41 -41.58 89.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.463 ' N ' HG13 ' A' ' 156' ' ' VAL . 16.9 t70 -52.85 -52.26 57.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.93 75.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -39.27 74.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.947 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -45.12 75.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.908 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 22.6 m -55.88 -41.83 75.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.69 -31.5 32.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.13 -22.76 62.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.823 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.63 -62.56 3.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.577 0.703 . . . . 0.0 111.142 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.823 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.5 Cg_endo -69.83 -44.17 2.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -59.13 -31.37 68.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.938 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.8 t -56.71 -52.12 66.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.875 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.59 -47.57 80.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.871 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.8 -51.28 69.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.511 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.0 tm? -58.95 -44.71 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.21 -35.57 67.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -50.04 60.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.54 -40.11 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.6 tp -70.0 -49.82 47.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' ALA . . . . . 0.54 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.92 -34.31 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.15 -34.22 56.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.125 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -62.11 -49.05 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 175' ' ' ALA . 1.5 pp -66.99 -49.31 65.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' GLU . . . . . 0.523 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.9 OUTLIER -59.39 -49.59 77.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.84 -46.8 78.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.86 -39.67 74.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -67.55 -28.17 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.868 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.75 -56.1 20.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.848 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.84 -27.53 65.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.16 -31.25 65.24 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.3 -48.7 66.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.48 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.25 -23.1 38.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.766 0.317 . . . . 0.0 111.054 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.81 -30.53 62.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.816 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -43.62 98.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.8 -48.82 43.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.097 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.94 -50.52 73.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -56.12 -46.7 79.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.919 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.19 -50.73 61.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.844 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.36 -31.01 68.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.123 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.41 -49.09 17.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.48 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.0 m -66.58 -48.36 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.147 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 26.3 pt-20 -70.86 -36.1 72.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -58.88 -47.64 84.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 mp -72.29 -29.8 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 58.0 m -56.91 -51.2 70.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 37.0 p -69.39 -50.35 46.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.151 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.41 -55.57 27.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 61.4 m -54.43 -35.88 63.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.875 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.85 -46.99 86.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -78.35 -27.84 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.04 -21.65 63.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.131 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.48 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -62.35 -60.71 9.26 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.561 0.696 . . . . 0.0 110.871 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 54.3 Cg_endo -69.72 -28.34 25.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.685 2.257 . . . . 0.0 112.366 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.78 -31.59 57.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.15 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.8 -38.39 73.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -54.19 -50.57 66.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.03 -31.18 58.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.849 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.59 -52.11 66.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -35.57 78.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.848 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -57.2 -48.91 77.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.866 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.82 -29.79 72.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.481 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.36 -32.4 73.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.8 OUTLIER -52.48 -61.65 4.31 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.595 0.712 . . . . 0.0 110.896 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.78 -43.79 2.44 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.661 2.241 . . . . 0.0 112.364 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 217' ' ' GLY . 57.0 t -57.2 -55.08 22.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.14 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.73 -33.19 71.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.621 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -68.43 -34.98 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.92 83.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.858 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -65.6 -42.57 91.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.34 -44.84 90.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 223' ' ' GLU . 42.9 t -55.54 -42.69 69.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.102 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -49.82 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -65.08 -38.5 90.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 233' ' ' LEU . 2.3 mm? -64.96 -34.05 77.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.21 -30.98 65.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.88 56.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.069 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -67.18 -36.54 81.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.945 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.16 -35.97 69.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.78 -49.14 32.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.87 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.31 -37.27 80.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.9 m -71.04 -46.37 62.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.161 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -56.46 -53.93 51.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.87 -48.79 78.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.9 -34.53 69.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.45 -57.47 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.946 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.12 -35.3 71.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -58.47 -52.2 66.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -32.81 63.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' THR . . . . . 0.861 HG22 HD23 ' B' ' 82' ' ' LEU . 95.3 m -62.09 -25.92 67.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.168 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -34.39 27.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.9 -27.71 14.43 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.488 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.861 HD23 HG22 ' B' ' 79' ' ' THR . 2.4 pp -48.7 -37.51 18.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.778 0.323 . . . . 0.0 110.913 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.64 -49.78 76.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -59.68 -44.87 93.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.92 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.73 -49.71 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 6.3 mtp -58.26 -41.42 84.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.79 -50.58 73.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.89 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.64 -44.43 90.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.2 OUTLIER -56.28 -47.82 77.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.37 -49.39 76.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.35 -47.4 72.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.929 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.68 -34.95 79.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.9 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' B' ' 89' ' ' ASP . 76.1 t -66.48 -32.15 56.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.159 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -75.5 -53.29 8.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.91 75.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.104 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -77.76 -33.69 52.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.881 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -55.43 -46.43 78.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.561 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 5.2 mm-40 -43.48 -66.24 0.47 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.576 0.703 . . . . 0.0 110.913 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.561 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.73 -31.46 20.62 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 0.0 112.349 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 100' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.5 t80 -58.66 -24.7 61.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.88 -50.14 15.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.929 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.83 -34.38 73.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.69 -47.56 69.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.09 -52.61 63.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.31 -46.16 84.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -62.2 -22.56 66.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.872 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -72.95 -47.41 45.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.89 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.86 -30.82 71.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -63.98 -56.4 15.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.14 -34.29 72.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -70.57 -31.68 68.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.904 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' MET . . . . . 0.41 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 1.2 tmt? -69.95 -54.48 13.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.15 -35.52 81.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.51 -25.94 54.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.953 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.9 t80 -63.13 -55.57 24.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.932 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -74.43 -33.94 63.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.443 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 72.6 tp60 -69.58 -21.93 63.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -91.24 -36.31 13.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 97.2 t -65.68 -32.62 58.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.475 ' N ' ' HD2' ' B' ' 143' ' ' PRO . 2.8 tt0 -60.67 -61.45 7.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.672 0.749 . . . . 0.0 110.89 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.75 -51.54 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.342 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 23.3 tp -70.84 -64.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.4 -32.21 1.76 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.462 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -77.74 -47.32 19.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 110.882 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 -45.68 78.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.5 mmt -64.91 -51.94 59.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.836 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.7 tpp85 -60.29 -43.59 96.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -66.75 -51.69 52.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.848 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.49 -31.91 70.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.655 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.48 -47.27 76.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.088 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 12.8 tpt85 -59.16 -45.3 91.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.65 -34.19 67.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.133 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -68.87 -50.05 53.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.83 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.655 HG12 ' O ' ' B' ' 152' ' ' ALA . 8.7 p -65.23 -41.36 91.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 157' ' ' ASP . . . . . 0.426 ' N ' HG13 ' B' ' 156' ' ' VAL . 17.1 t70 -53.06 -51.95 60.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.05 -48.55 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -37.93 73.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -44.96 74.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 22.8 m -56.15 -41.86 76.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.164 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.56 -31.14 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.87 -22.64 62.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.837 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.84 -62.52 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.577 0.703 . . . . 0.0 111.121 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.837 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.76 -42.43 3.41 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.71 2.273 . . . . 0.0 112.35 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -60.74 -31.16 70.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.943 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.7 t -57.4 -51.85 67.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.829 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.23 -47.64 81.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.27 -51.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.877 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.512 ' O ' HD22 ' B' ' 170' ' ' LEU . 2.0 tm? -58.86 -44.45 91.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.36 -36.07 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -49.44 64.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.25 -41.47 96.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 25.1 tp -69.27 -48.94 60.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.939 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 175' ' ' ALA . . . . . 0.534 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.1 -34.34 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.102 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.41 57.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.124 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -61.98 -48.89 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' B' ' 175' ' ' ALA . 1.6 pp -67.32 -48.96 66.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 179' ' ' GLU . . . . . 0.53 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.9 OUTLIER -59.3 -50.32 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.61 77.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.063 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -57.13 -39.39 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -68.3 -28.23 67.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -55.76 23.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.854 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.92 -27.38 65.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.24 -31.41 65.8 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.18 -48.81 66.09 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.473 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.15 -23.18 38.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.318 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.72 -30.53 62.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -43.77 98.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.84 -48.68 44.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.117 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.96 -50.41 73.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -56.38 -46.69 79.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.17 -50.22 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.85 -30.97 69.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.3 -48.95 18.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.26 -34.12 76.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.1 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.4 m -65.87 -48.66 70.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -70.91 -36.15 72.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.82 -47.56 84.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.37 -29.75 64.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.926 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 57.7 m -56.98 -51.09 70.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.848 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 36.6 p -69.37 -50.27 47.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.158 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.49 -55.58 27.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.879 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 61.3 m -54.51 -35.85 63.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.835 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.87 -46.88 86.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.888 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -78.47 -27.83 46.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.11 -21.74 63.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.485 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -62.27 -60.75 9.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.554 0.692 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.8 -28.25 25.28 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.711 2.274 . . . . 0.0 112.333 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.95 -31.55 56.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.126 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.62 -38.5 73.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.926 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -54.12 -50.43 66.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -75.88 -31.11 59.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.72 -52.22 66.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -35.46 78.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -57.21 -48.87 77.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.491 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.89 -29.82 72.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.493 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.31 -32.47 73.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.8 OUTLIER -52.45 -61.67 4.27 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.616 0.722 . . . . 0.0 110.923 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 54.0 Cg_endo -69.73 -43.83 2.45 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 0.0 112.398 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.491 HG23 ' O ' ' B' ' 217' ' ' GLY . 56.6 t -57.23 -55.11 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.171 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -33.32 71.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.632 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.4 mt-10 -68.45 -34.92 76.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -47.96 83.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.856 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -65.64 -42.4 91.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.42 -44.9 89.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.867 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.632 HG23 ' O ' ' B' ' 223' ' ' GLU . 43.0 t -55.53 -42.67 69.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.14 -49.82 76.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -65.1 -38.53 91.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.508 HD13 HD11 ' B' ' 233' ' ' LEU . 2.3 mm? -64.87 -34.09 77.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.907 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.26 -30.91 65.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.55 -50.75 57.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.508 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -67.31 -36.42 81.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.2 -36.06 69.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.73 -49.13 33.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.877 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -60.35 -37.24 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.925 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 98.1 m -70.99 -46.44 62.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.169 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 7.1 ttmt -56.45 -53.9 51.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.84 -48.81 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 29.6 mt -57.92 -34.55 69.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.925 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.838 0.351 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' A' ' 79' ' ' THR . 35.1 tp -59.85 -55.26 36.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.948 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.61 -33.81 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.885 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.18 -49.4 74.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.54 -34.01 76.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 75' ' ' LEU . 28.8 p -73.11 -23.45 60.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -50.96 -31.96 19.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.32 -30.7 40.95 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 79' ' ' THR . 2.6 pp -51.67 -36.88 48.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.35 -49.67 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.876 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.23 -41.73 98.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.04 -48.08 81.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.3 mmt -62.5 -40.09 95.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -58.76 -50.24 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.869 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -60.56 -46.24 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 20.3 t70 -55.62 -47.59 76.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.888 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tp -58.15 -50.85 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.08 66.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.836 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -62.64 -37.96 88.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.893 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 96.2 t -65.34 -31.68 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.138 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -74.93 -53.93 8.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.895 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.57 -30.67 71.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.96 -36.11 42.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.34 -43.33 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.187 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.551 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.9 mm-40 -44.33 -65.23 0.64 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.61 0.719 . . . . 0.0 110.943 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.551 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.9 Cg_endo -69.8 -27.27 26.46 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -53.72 -57.29 11.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.628 HD23 ' HB3' ' B' ' 160' ' ' ARG . 1.7 mp -53.65 -29.13 36.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.929 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.82 -47.04 73.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.04 -42.83 93.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -50.74 72.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.883 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -47.5 85.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -26.2 68.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -45.79 67.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.868 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -23.17 61.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -66.21 -64.83 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -63.4 -34.78 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.892 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -70.51 -30.07 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.874 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.408 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 1.2 tmt? -65.65 -51.64 57.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.852 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -40.67 96.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -25.34 56.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.773 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.6 t80 -61.92 -54.97 34.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -71.18 -39.26 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.854 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -65.28 -25.67 67.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.35 -40.91 12.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.9 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 115' ' ' TYR . 59.0 t -57.61 -31.76 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.544 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.9 mt-10 -60.12 -65.09 2.31 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.587 0.708 . . . . 0.0 110.868 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.544 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 54.1 Cg_endo -69.73 -51.42 0.39 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.714 2.276 . . . . 0.0 112.374 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -63.61 1.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.907 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.18 -31.84 1.48 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.481 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -75.37 -43.58 49.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 0.0 110.857 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -71.83 -37.37 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -67.54 -47.74 69.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.834 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.403 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 9.3 tpp180 -66.31 -39.92 89.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.87 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -71.37 -51.34 24.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -62.46 -38.27 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.22 -42.47 99.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.79 -50.91 70.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.05 70.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.084 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.16 -50.6 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 10.7 p -67.34 -35.53 74.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.129 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -57.3 -51.25 70.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.01 56.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.087 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 22.2 tp -56.76 -42.57 79.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.587 ' HB3' HD23 ' B' ' 101' ' ' LEU . 0.6 OUTLIER -68.47 -38.88 81.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.88 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 61.8 m -56.95 -47.61 80.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.09 -34.9 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.87 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.3 tp -72.31 -15.08 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.815 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -62.3 -62.05 6.5 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.609 0.719 . . . . 0.0 111.15 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.815 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.73 -39.4 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.364 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -63.16 -34.22 77.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.95 -48.58 73.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -62.02 -49.39 76.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.46 -51.07 68.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 31.7 tp -60.62 -50.04 75.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.57 -34.01 76.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.833 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.86 -35.23 79.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -49.02 38.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.867 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -51.47 47.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.31 -43.02 74.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.109 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.95 -39.35 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.05 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -33.43 75.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.887 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.76 -50.17 26.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.39 -50.93 57.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.27 76.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.086 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 18.8 tp -63.79 -34.78 78.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -65.28 -33.54 76.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.82 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.53 -45.16 77.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -67.56 -26.28 66.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.12 -33.57 37.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.445 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.1 -32.3 35.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.502 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.25 -25.74 42.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 111.133 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.75 -35.25 65.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -37.18 86.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.907 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.33 38.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.063 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -49.08 77.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.47 -42.69 92.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.84 -50.16 66.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.96 -30.92 70.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.088 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.36 -49.73 18.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.66 -34.82 77.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.156 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.1 m -64.23 -47.67 78.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.14 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.87 -37.77 79.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -42.85 90.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -30.95 64.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 20.3 m -57.18 -51.02 70.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.865 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 4.8 p -67.74 -50.38 57.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.159 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.0 tp -55.06 -53.06 60.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 14.1 m -54.64 -36.17 64.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.814 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -46.27 88.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -28.85 48.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.896 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.08 62.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.489 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 4.4 tptt -61.07 -60.37 10.85 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.589 0.709 . . . . 0.0 110.893 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.71 -29.16 24.54 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.694 2.263 . . . . 0.0 112.41 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.54 -29.82 56.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.085 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tt -72.54 -38.66 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.91 -51.22 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.883 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.75 -31.25 61.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.4 HD23 ' N ' ' A' ' 215' ' ' ARG . 4.7 tt -62.91 -52.46 62.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.95 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 215' ' ' ARG . . . . . 0.4 ' N ' HD23 ' A' ' 214' ' ' LEU . 36.7 ttp180 -63.7 -37.76 88.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.874 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -56.67 -48.32 77.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.75 -29.25 74.42 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.457 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.88 -33.07 74.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.836 0.351 . . . . 0.0 110.883 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.1 mp -48.3 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.583 0.706 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.2 Cg_endo -69.78 -37.72 8.74 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.683 2.255 . . . . 0.0 112.324 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 217' ' ' GLY . 47.2 t -58.55 -54.87 27.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.172 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -34.98 74.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.6 OUTLIER -65.22 -34.62 78.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.15 -48.43 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.31 -43.18 70.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -62.49 -48.86 77.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.828 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 223' ' ' GLU . 24.9 t -56.74 -38.78 59.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.56 -50.1 75.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.865 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.78 -38.48 90.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.762 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -65.22 -34.76 79.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 10.8 m -70.14 -30.42 67.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.829 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.16 48.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.123 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.762 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -69.2 -38.99 78.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.65 -39.65 84.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -72.26 -48.62 41.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.7 -35.89 69.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 93.9 m -70.73 -47.33 60.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.109 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -53.79 52.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -61.73 -48.72 79.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.83 -35.09 70.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 179.919 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.886 0.374 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' B' ' 79' ' ' THR . 35.0 tp -59.86 -55.34 35.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.52 -33.82 76.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.876 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -49.51 73.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.46 -34.05 76.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.877 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' B' ' 75' ' ' LEU . 28.8 p -73.14 -23.4 60.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.03 -31.93 19.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.893 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.42 -30.7 41.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.476 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.504 HD23 ' O ' ' B' ' 79' ' ' THR . 2.5 pp -51.65 -36.79 47.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -58.49 -49.61 76.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.11 -42.01 98.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.923 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.74 -48.39 79.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.2 mmt -62.27 -40.0 94.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 44.4 m -58.63 -50.23 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.835 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -60.45 -46.52 89.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.709 ' O ' HG23 ' B' ' 93' ' ' VAL . 20.3 t70 -55.44 -47.97 75.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.891 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.86 -50.78 72.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.11 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.12 -36.66 84.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.925 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 89' ' ' ASP . 97.3 t -66.45 -31.76 55.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -75.21 -54.93 6.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.18 72.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.68 -36.57 43.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -54.22 -47.45 67.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.108 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.57 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.0 mm-40 -42.68 -66.76 0.39 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.562 0.696 . . . . 0.0 110.904 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.57 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.69 -24.32 30.12 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.703 2.268 . . . . 0.0 112.339 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -53.54 -54.98 29.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.941 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.587 HD23 ' HB3' ' A' ' 160' ' ' ARG . 0.3 OUTLIER -59.46 -28.36 66.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.87 -48.49 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.848 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.28 -43.94 84.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -51.54 67.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.877 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -47.52 85.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.25 -25.48 64.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.97 -48.93 41.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.918 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -25.63 67.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -68.02 -66.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.9 -35.51 76.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.858 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -70.96 -29.3 65.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.902 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' MET . . . . . 0.403 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 0.8 OUTLIER -65.49 -51.37 60.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.826 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -39.11 93.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -25.72 56.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.895 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.726 ' O ' HG23 ' B' ' 119' ' ' VAL . 17.6 t80 -64.23 -55.58 20.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.974 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -69.4 -38.61 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -66.6 -24.51 66.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -91.79 -42.56 10.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.726 HG23 ' O ' ' B' ' 115' ' ' TYR . 62.2 t -56.98 -31.47 36.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.527 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mt-10 -61.45 -64.85 2.61 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.649 0.738 . . . . 0.0 110.904 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.527 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.4 Cg_endo -69.74 -51.82 0.36 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -63.95 1.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.99 -31.0 1.11 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -77.2 -45.21 27.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -70.24 -43.84 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -64.9 -51.2 63.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.408 ' HG3' ' HG3' ' A' ' 112' ' ' MET . 10.3 tpp180 -62.09 -41.09 97.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.857 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -68.31 -50.92 50.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.815 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -62.26 -33.73 75.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.57 -49.68 72.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.09 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -56.66 -49.54 74.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.897 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.99 -32.93 72.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.106 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.5 -50.15 60.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.837 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.3 -35.55 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.13 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -57.6 -50.78 72.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.1 58.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.109 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 22.0 tp -57.37 -42.21 81.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 160' ' ' ARG . . . . . 0.628 ' HB3' HD23 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -67.64 -39.54 84.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 86.1 m -57.25 -46.88 82.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.48 -34.94 47.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 tp -72.4 -15.37 61.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.93 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.794 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -62.13 -61.96 6.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.582 0.706 . . . . 0.0 111.076 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.794 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.73 -38.7 7.5 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -63.86 -34.95 79.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.02 -48.37 76.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -62.2 -49.24 76.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.867 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.4 -51.16 68.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.912 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.61 -50.1 74.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.35 -33.9 76.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -35.33 80.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -48.82 41.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.38 48.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.888 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.56 -42.75 75.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.04 -39.11 63.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.142 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -34.15 77.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.892 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 178' ' ' LEU . 0.4 OUTLIER -72.52 -49.35 33.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -67.19 -50.48 60.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.71 80.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 19.1 tp -64.36 -34.51 78.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -66.62 -33.77 76.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -44.71 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.875 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -68.05 -26.09 65.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.09 -33.59 37.7 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.482 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.0 -32.38 34.58 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.459 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.68 42.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.339 . . . . 0.0 111.128 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.73 -35.69 65.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -37.35 86.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.85 -49.25 39.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.137 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -48.44 79.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.88 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.92 -42.83 94.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.88 -49.99 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.83 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.07 -30.91 70.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.53 -49.6 18.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.71 -35.03 78.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 63.5 m -64.16 -47.56 79.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.163 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.85 -37.88 79.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.847 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -42.74 90.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.849 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.0 -30.9 64.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 20.2 m -57.28 -50.95 71.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 4.9 p -67.68 -50.38 57.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.9 tp -55.09 -53.04 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 13.9 m -54.71 -36.12 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.828 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -46.23 88.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.859 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -28.78 48.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.15 62.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.494 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 4.5 tptt -61.12 -60.3 11.06 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.564 0.697 . . . . 0.0 110.876 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.7 Cg_endo -69.8 -29.17 24.09 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.663 2.242 . . . . 0.0 112.3 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -29.76 56.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.109 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.39 -38.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.84 -51.03 64.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.81 -31.27 61.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.413 HD23 ' N ' ' B' ' 215' ' ' ARG . 4.7 tt -62.93 -52.45 62.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.919 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 215' ' ' ARG . . . . . 0.413 ' N ' HD23 ' B' ' 214' ' ' LEU . 36.5 ttp180 -63.88 -37.6 88.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -56.64 -48.4 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.581 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.79 -29.3 74.49 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.482 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.74 -33.13 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.886 0.374 . . . . 0.0 110.956 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.1 mp -48.28 -60.79 3.87 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 0.0 110.916 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.8 Cg_endo -69.72 -37.72 8.88 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.675 2.25 . . . . 0.0 112.328 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.581 HG23 ' O ' ' B' ' 217' ' ' GLY . 46.3 t -58.65 -54.81 28.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.51 -35.12 75.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.465 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.6 OUTLIER -65.15 -34.61 78.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.844 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.18 -48.46 79.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.789 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.27 -43.21 70.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.1 tttm -62.49 -48.83 77.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 223' ' ' GLU . 24.8 t -56.69 -38.82 59.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.55 -50.13 74.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.82 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -38.48 90.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.907 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.765 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -65.23 -34.82 79.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.937 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 10.4 m -70.05 -30.41 67.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.45 -50.22 47.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.765 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -69.12 -39.03 79.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.908 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -67.62 -39.56 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.33 -48.62 40.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.66 -35.92 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 93.5 m -70.67 -47.35 60.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -53.76 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -61.82 -48.63 79.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 28.0 mt -57.86 -35.06 70.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.921 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.936 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.804 0.335 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.74 -55.13 36.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.31 -38.29 73.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.03 -51.66 67.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -30.72 61.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.959 HG22 HD23 ' A' ' 82' ' ' LEU . 91.4 m -59.25 -22.08 60.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.169 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.01 -34.52 13.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.88 -27.15 20.11 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.469 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.959 HD23 HG22 ' A' ' 79' ' ' THR . 2.0 pp -48.31 -35.65 12.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.801 0.334 . . . . 0.0 110.893 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -50.22 74.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.13 -43.81 98.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.41 -49.28 74.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.63 -41.58 86.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -58.62 -50.6 73.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.837 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.83 -45.08 90.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.16 -46.84 79.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.23 -50.39 73.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.78 -48.27 69.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.68 -35.57 81.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.886 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 89' ' ' ASP . 63.2 t -65.62 -32.29 57.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.162 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.39 -52.77 11.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.73 -33.27 73.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.088 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -78.03 -33.15 51.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.82 -42.68 86.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.178 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 mt-30 -44.6 -64.89 0.71 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.592 0.71 . . . . 0.0 110.918 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.8 -32.9 17.52 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.717 2.278 . . . . 0.0 112.317 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.413 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 15.7 t80 -59.11 -25.22 63.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.1 -50.88 20.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.8 -32.52 73.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.896 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -47.4 65.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.913 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -56.09 -52.41 64.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.23 -47.54 76.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -61.0 -22.75 64.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.919 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -74.32 -45.98 43.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -30.53 71.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -66.18 -55.88 14.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -69.65 -34.46 74.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.94 -31.73 68.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.03 -54.24 16.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.897 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.51 -35.13 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.62 -25.91 54.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.786 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -65.25 -54.62 26.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -41.31 65.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.403 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 39.3 tt0 -62.01 -25.81 67.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -84.81 -39.23 18.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 115' ' ' TYR . 84.9 t -59.45 -32.49 48.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.157 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.541 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 4.7 mt-10 -57.61 -64.78 2.28 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.645 0.736 . . . . 0.0 110.921 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.8 Cg_endo -69.74 -51.14 0.4 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.699 2.266 . . . . 0.0 112.356 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.2 tp -67.27 -64.3 0.88 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.23 -32.67 3.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.451 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -74.36 -43.84 54.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -70.89 -35.49 72.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -49.96 64.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -68.12 -37.13 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.879 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -71.24 -53.57 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -61.44 -37.05 82.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.848 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.577 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -63.77 -40.22 96.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.113 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ARG . . . . . 0.401 ' HG3' ' CH2' ' B' ' 108' ' ' TRP . 0.0 OUTLIER -63.02 -49.65 73.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.99 -32.39 69.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -69.82 -50.87 38.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.4 p -67.09 -41.55 87.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.131 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.46 ' N ' HG13 ' A' ' 156' ' ' VAL . 6.3 t70 -53.33 -52.63 58.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.31 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.109 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 163' ' ' LEU . 2.1 mp -56.77 -45.3 82.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -63.31 -44.09 95.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.882 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 32.2 m -56.09 -40.78 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.41 -31.23 33.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 159' ' ' LEU . 1.8 mm? -69.34 -22.27 63.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.899 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.812 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.97 -62.7 3.81 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.549 0.69 . . . . 0.0 111.114 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.812 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.83 -45.85 1.4 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.67 2.247 . . . . 0.0 112.347 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.55 -29.13 64.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -52.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.836 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.86 -33.18 75.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.839 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.71 -51.91 30.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.846 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.29 -49.34 64.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.88 -35.95 69.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.87 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.86 -41.9 82.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.843 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -72.31 -40.52 67.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.865 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -50.56 38.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.928 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.62 -40.96 80.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.092 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.1 -41.83 61.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.099 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -65.72 -34.15 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.558 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -69.54 -50.07 48.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' GLU . . . . . 0.558 ' N ' HD23 ' A' ' 178' ' ' LEU . 77.1 mt-10 -69.4 -35.57 75.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.13 -49.17 53.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.125 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.9 -43.15 81.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -70.28 -30.86 67.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.881 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -55.48 31.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.85 -26.79 68.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.74 -34.47 44.39 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.69 -33.3 41.61 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.498 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.39 42.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.32 . . . . 0.0 111.092 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -73.1 -32.67 65.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -39.49 93.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.958 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.38 35.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.08 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -49.56 75.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -57.99 -44.24 87.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -53.64 -49.37 68.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.878 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.41 -31.3 70.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.096 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -49.6 16.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.57 -34.7 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.114 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' THR . . . . . 0.602 HG21 HD22 ' B' ' 240' ' ' LEU . 86.1 m -65.76 -47.57 74.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.148 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.44 -36.16 76.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.91 -46.44 87.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.837 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -30.13 64.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.03 -51.11 70.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.813 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.64 -50.59 50.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.32 -55.07 32.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.913 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 68.1 m -54.23 -36.03 63.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.84 -46.53 87.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -29.83 52.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.38 -21.89 64.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.506 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 2.1 mttt -60.93 -63.08 4.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.562 0.696 . . . . 0.0 110.921 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.2 Cg_endo -69.78 -26.82 27.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.355 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.04 57.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 211' ' ' LEU . 2.8 tm? -72.07 -37.18 69.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.25 -50.85 66.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -31.06 57.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.838 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.44 -50.93 70.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 215' ' ' ARG . . . . . 0.426 ' HD3' HD21 ' A' ' 211' ' ' LEU . 0.0 OUTLIER -68.37 -35.84 78.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -57.06 -48.94 77.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.49 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.97 -29.78 72.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.459 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -32.66 74.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.85 0.357 . . . . 0.0 110.891 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.475 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -52.34 -61.67 4.23 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.3 Cg_endo -69.8 -43.85 2.38 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.28 . . . . 0.0 112.332 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 217' ' ' GLY . 54.1 t -57.27 -55.2 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.128 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.65 -33.25 71.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.955 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.631 ' O ' HG23 ' A' ' 227' ' ' VAL . 5.0 mt-10 -68.56 -34.86 76.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 70.6 m -59.96 -47.87 84.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -66.01 -41.93 90.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -45.13 87.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.93 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 223' ' ' GLU . 44.3 t -55.38 -42.82 69.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.152 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -49.94 75.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.841 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -64.78 -37.59 88.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.861 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.596 HD13 HD11 ' A' ' 233' ' ' LEU . 1.6 mm? -64.93 -34.52 78.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.08 -30.48 65.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.02 -50.84 53.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.109 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.596 HD11 HD13 ' A' ' 230' ' ' LEU . 1.4 pp -67.43 -35.57 79.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -39.51 69.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.91 -49.2 31.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -57.71 -41.44 81.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.966 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 80.5 m -65.8 -45.56 81.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.118 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.74 53.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 10.8 mtmm -57.78 -49.55 76.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.926 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.607 HD22 HG21 ' B' ' 197' ' ' THR . 0.5 OUTLIER -58.36 -35.11 71.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.904 0.383 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.77 -55.16 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.28 -38.3 73.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -51.5 67.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.908 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' THR . . . . . 0.989 HG22 HD23 ' B' ' 82' ' ' LEU . 93.9 m -59.23 -21.96 60.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.141 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.24 -34.46 15.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.98 -27.15 20.96 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.509 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.989 HD23 HG22 ' B' ' 79' ' ' THR . 2.0 pp -48.39 -35.44 12.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 110.903 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -50.23 74.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -43.82 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.902 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.34 -49.33 74.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.74 -41.34 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.93 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -58.72 -50.48 73.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.92 -45.42 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.706 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -55.76 -47.04 77.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -50.21 73.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -48.12 70.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.866 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.81 -35.6 81.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.841 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 89' ' ' ASP . 67.9 t -65.68 -32.34 57.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.83 -53.07 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.893 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 -34.65 74.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.074 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -77.96 -33.48 51.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.909 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.94 -45.68 80.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.105 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.566 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.9 mt-30 -43.68 -66.16 0.49 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.566 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.8 -32.48 18.34 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.33 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' TYR . . . . . 0.419 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.0 t80 -58.76 -24.27 61.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.41 -50.07 15.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -59.87 -32.51 70.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.22 -47.11 62.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -55.84 -53.1 60.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.48 -47.66 78.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -60.87 -22.38 64.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -73.51 -47.54 40.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.401 ' CH2' ' HG3' ' A' ' 153' ' ' ARG . 0.1 OUTLIER -63.78 -31.81 73.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -64.03 -56.15 17.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.909 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -70.47 -34.26 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.73 -32.43 69.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -54.21 15.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.841 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.97 -35.6 81.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.67 -25.65 53.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.935 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.6 t80 -65.16 -54.84 23.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.13 -37.72 66.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -65.62 -24.35 67.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.923 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -88.02 -40.11 14.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 94.5 t -60.11 -32.75 51.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.153 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 4.7 mt-10 -58.45 -64.52 2.74 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.667 0.746 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.8 Cg_endo -69.78 -50.68 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.661 2.241 . . . . 0.0 112.304 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.21 -64.84 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 149' ' ' ARG . . . -45.39 -31.02 3.21 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.467 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -76.51 -44.52 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 110.918 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -70.44 -42.41 71.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 15.8 mmt -65.07 -53.35 47.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.885 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' B' ' 145' ' ' GLY . 1.6 tmm_? -61.16 -42.34 98.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.839 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -66.43 -51.87 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.79 -32.05 71.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.671 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.17 -47.52 76.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.085 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -45.32 91.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.33 -33.67 67.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.077 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -69.68 -50.19 46.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.671 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.8 p -65.14 -41.56 92.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 157' ' ' ASP . . . . . 0.428 ' N ' HG13 ' B' ' 156' ' ' VAL . 6.1 t70 -53.67 -52.06 61.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.45 75.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.436 ' O ' HD23 ' B' ' 163' ' ' LEU . 2.7 mp -56.92 -43.38 81.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.91 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -63.46 -44.37 94.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 25.1 m -56.25 -41.39 75.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.148 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -31.13 39.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.436 HD23 ' O ' ' B' ' 159' ' ' LEU . 1.8 mm? -70.13 -22.37 63.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.844 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.89 -62.86 3.53 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.579 0.704 . . . . 0.0 111.151 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.3 Cg_endo -69.76 -44.34 2.13 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.675 2.25 . . . . 0.0 112.337 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -58.66 -29.91 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.9 67.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.83 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.48 -33.51 76.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.73 -51.89 30.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 20.5 tp -67.18 -49.34 65.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.921 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.96 -36.22 70.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -67.63 -41.6 83.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -72.38 -40.75 67.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.18 -50.35 41.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.974 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.79 -40.73 80.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.21 -41.31 61.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.075 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -66.16 -34.01 77.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.864 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.56 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.2 tt -69.62 -49.72 51.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.933 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 179' ' ' GLU . . . . . 0.56 ' N ' HD23 ' B' ' 178' ' ' LEU . 77.0 mt-10 -69.27 -36.42 77.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.906 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -69.68 -49.14 56.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 2.2 tt -57.55 -41.81 81.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -71.73 -31.42 66.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.44 -55.27 33.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.862 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.55 -26.8 68.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.73 -34.58 44.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.462 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.52 -33.37 40.52 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.47 42.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.75 0.309 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -73.02 -32.62 65.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -39.63 93.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.22 36.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -49.5 75.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.04 -44.37 87.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.919 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -53.5 -49.39 67.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.29 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -49.65 16.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.59 -34.68 78.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 197' ' ' THR . . . . . 0.607 HG21 HD22 ' A' ' 240' ' ' LEU . 85.4 m -65.68 -47.56 75.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.113 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.49 -36.23 76.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.85 -46.39 87.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -30.16 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.01 -51.02 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.61 -50.61 50.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.37 -55.08 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 68.0 m -54.24 -36.06 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.86 -46.51 87.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -30.02 52.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.76 64.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.1 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.513 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 2.1 mttt -61.01 -63.23 4.57 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.586 0.708 . . . . 0.0 110.865 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.77 -26.8 27.15 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 0.0 112.31 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -31.98 57.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 211' ' ' LEU . . . . . 0.488 ' C ' HD13 ' B' ' 211' ' ' LEU . 2.7 tm? -72.02 -37.18 69.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.13 -50.85 65.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.865 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.32 -31.16 58.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.32 -50.97 70.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.9 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 215' ' ' ARG . . . . . 0.43 ' HD3' HD21 ' B' ' 211' ' ' LEU . 0.0 OUTLIER -68.4 -35.9 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.869 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.07 -48.91 77.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.96 -29.78 72.4 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.494 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.18 -32.63 74.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 0.0 110.908 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.9 OUTLIER -52.39 -61.7 4.21 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.612 0.72 . . . . 0.0 110.885 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.69 -43.96 2.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.719 2.279 . . . . 0.0 112.364 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 217' ' ' GLY . 57.1 t -57.24 -55.15 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.109 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.72 -33.23 71.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.635 ' O ' HG23 ' B' ' 227' ' ' VAL . 5.0 mt-10 -68.49 -34.84 76.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 70.7 m -60.02 -47.85 84.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -65.84 -42.16 90.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -44.93 88.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.889 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.635 HG23 ' O ' ' B' ' 223' ' ' GLU . 42.9 t -55.46 -42.86 69.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.159 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.22 -49.96 75.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -64.69 -37.7 88.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.899 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.584 HD13 HD11 ' B' ' 233' ' ' LEU . 1.6 mm? -64.86 -34.5 78.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.943 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.1 -30.51 65.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.96 -50.86 53.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.584 HD11 HD13 ' B' ' 230' ' ' LEU . 1.4 pp -67.41 -35.64 79.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.0 -39.61 69.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.81 -49.15 32.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.897 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -57.79 -41.45 82.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.908 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 81.3 m -65.77 -45.53 82.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.76 53.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 10.7 mtmm -57.82 -49.51 76.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.602 HD22 HG21 ' A' ' 197' ' ' THR . 0.5 OUTLIER -58.48 -35.02 71.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.885 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.865 0.364 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.07 -55.25 27.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.53 -38.7 81.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.941 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.07 -50.94 69.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.21 -32.62 61.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.872 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.9 m -65.92 -23.92 66.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.47 -33.66 22.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.98 -30.73 54.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.487 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.678 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.9 tm? -51.73 -36.31 46.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.807 0.336 . . . . 0.0 110.932 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -49.79 75.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -41.3 96.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -48.34 81.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -40.05 96.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -50.6 73.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.78 -46.01 91.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.92 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.717 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.2 t70 -56.1 -47.59 77.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -51.47 69.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -47.8 65.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.26 -38.41 91.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 89' ' ' ASP . 88.7 t -65.0 -31.75 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -74.96 -54.26 7.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.2 -30.16 70.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.156 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -79.0 -36.64 40.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.03 -45.0 83.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.122 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.552 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.3 mm-40 -43.84 -65.43 0.59 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.578 0.704 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.552 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 54.0 Cg_endo -69.76 -25.63 28.38 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.639 2.226 . . . . 0.0 112.367 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -53.56 -58.14 8.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -54.92 -28.57 51.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.02 -47.62 73.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -44.19 87.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.863 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -50.52 72.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.89 -47.35 86.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -60.93 -26.24 67.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.927 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -45.27 62.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.895 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' TRP . . . . . 0.55 ' HE1' ' NH1' ' B' ' 149' ' ' ARG . 0.0 OUTLIER -69.96 -23.3 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -68.12 -64.48 0.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -62.94 -34.97 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.64 -30.32 66.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.924 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 45.3 ttp -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.9 -41.31 97.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -24.79 55.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.958 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.767 ' O ' HG23 ' A' ' 119' ' ' VAL . 6.6 t80 -63.66 -55.05 26.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -69.95 -42.72 72.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.33 -26.61 67.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.876 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -89.63 -37.81 14.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 115' ' ' TYR . 50.8 t -58.47 -31.73 43.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -60.91 -64.78 2.71 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.67 0.748 . . . . 0.0 110.903 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.75 -51.03 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.677 2.251 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.9 -63.48 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.11 -30.72 1.9 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.524 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.32 -43.72 60.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.859 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -74.95 -33.92 61.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -48.65 68.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.4 ' NH1' ' HE1' ' B' ' 108' ' ' TRP . 0.9 OUTLIER -69.21 -37.15 77.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -71.0 -50.82 30.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.7 -37.97 89.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.13 -43.51 98.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -62.18 -50.62 71.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.29 -30.29 69.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.118 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 35.7 t60 -68.36 -50.44 53.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.848 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.9 p -66.65 -37.26 79.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.161 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -57.2 -52.94 63.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.91 -49.15 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.549 ' O ' HD23 ' A' ' 163' ' ' LEU . 6.2 mt -56.43 -49.57 74.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.47 ' HB3' HD22 ' B' ' 101' ' ' LEU . 23.5 mmt-85 -60.17 -39.4 86.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 95.0 m -57.3 -48.04 79.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -76.14 -35.14 59.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.64 62.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.19 -62.43 5.98 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 0.0 111.133 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.8 -41.37 4.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.73 2.286 . . . . 0.0 112.323 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -61.57 -34.73 76.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.6 t -60.99 -45.76 93.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -62.56 -50.92 69.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.859 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.32 -51.43 69.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.551 ' C ' HD13 ' A' ' 170' ' ' LEU . 1.7 tm? -63.25 -46.57 86.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ARG . . . . . 0.405 ' HG3' HD11 ' B' ' 90' ' ' LEU . 1.8 tpt85 -60.39 -38.09 82.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -34.65 78.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.14 -49.0 60.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.77 -50.92 30.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.945 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.2 -45.84 72.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.35 -36.03 71.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -32.35 72.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.415 ' O ' HD12 ' A' ' 178' ' ' LEU . 4.8 tp -72.26 -50.88 23.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.48 -45.0 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.69 93.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 55.4 tp -58.81 -40.87 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -66.26 -31.82 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -55.3 33.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -65.74 -26.23 67.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.19 -33.66 38.55 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.502 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.23 -32.7 37.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.507 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.22 42.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.738 0.304 . . . . 0.0 111.078 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -72.91 -34.36 66.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.882 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.67 86.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.58 36.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.01 -48.77 77.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.892 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.27 -43.93 92.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' ' 197' ' ' THR . 85.1 t60 -53.27 -50.58 64.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.851 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.15 69.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -49.31 18.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.55 -36.72 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.081 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 197' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 193' ' ' HIS . 21.1 p -63.17 -47.58 82.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.148 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -35.96 80.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.55 -45.95 87.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.64 -30.24 65.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.943 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -50.9 71.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 54.3 m -68.18 -50.15 56.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.11 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.58 -54.05 46.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 67.0 m -54.59 -36.14 64.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.61 -47.78 83.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.905 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.2 -28.07 48.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.845 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.16 -22.08 63.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.152 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.494 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -60.22 -62.59 5.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.577 0.703 . . . . 0.0 110.908 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.494 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.81 -27.11 26.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.274 . . . . 0.0 112.354 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.82 -30.94 56.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.126 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.99 -37.52 66.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.879 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.06 -50.81 65.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.885 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.01 -30.71 61.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -51.35 70.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -37.18 81.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.73 -49.09 76.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.483 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.19 -29.42 73.3 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -62.98 -32.93 74.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 110.928 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -52.17 -61.77 4.03 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.583 0.706 . . . . 0.0 110.935 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.72 -43.74 2.52 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.703 2.269 . . . . 0.0 112.338 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 217' ' ' GLY . 52.9 t -57.26 -53.69 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.182 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.63 -33.52 71.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 227' ' ' VAL . 1.8 tt0 -65.0 -36.0 82.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 47.7 t -61.84 -48.32 81.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.13 -41.06 82.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.919 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.76 -45.44 86.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.929 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 223' ' ' GLU . 28.9 t -56.8 -41.57 75.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.148 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.96 -50.12 75.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.05 -38.08 84.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.403 ' HA ' HD21 ' A' ' 233' ' ' LEU . 0.4 OUTLIER -62.09 -35.87 79.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.48 -30.53 67.36 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.84 -51.29 57.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 230' ' ' LEU . 0.8 OUTLIER -70.12 -41.05 74.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.29 -43.4 98.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.28 -47.57 76.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.85 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -53.99 -39.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 13.0 m -67.04 -44.8 79.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.11 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -55.5 33.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.31 -49.07 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -57.84 -39.81 78.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.859 179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 52.7 t30 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.893 0.378 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.2 tp -63.14 -55.26 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.92 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.52 -38.71 81.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.04 -50.96 69.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.947 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -75.18 -32.69 61.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.885 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -65.77 -23.91 66.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.4 -33.63 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.95 -30.79 54.66 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.669 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.7 tm? -51.68 -36.42 46.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.8 0.333 . . . . 0.0 110.931 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -49.78 75.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.825 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -41.49 97.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -48.61 80.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -40.22 96.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -50.4 73.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.49 -46.73 88.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.721 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.1 t70 -55.85 -47.91 76.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.9 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.405 HD11 ' HG3' ' A' ' 171' ' ' ARG . 0.4 OUTLIER -57.8 -51.57 69.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.86 -47.96 64.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.45 -37.31 86.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 89' ' ' ASP . 88.6 t -65.7 -32.03 56.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.163 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -75.08 -55.49 5.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.945 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.98 -31.75 70.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.068 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt -78.78 -37.44 41.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.6 t -51.79 -51.6 26.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.576 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mm-40 -39.88 -67.27 0.29 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 110.895 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.576 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.76 -20.65 34.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 0.0 112.37 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.48 -55.55 24.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 160' ' ' ARG . 1.4 pp -62.24 -28.39 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.969 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -49.23 78.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.07 -43.84 77.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.814 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.25 -50.81 71.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.844 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.7 -47.71 84.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -59.53 -25.41 64.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.39 -47.34 50.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.962 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' TRP . . . . . 0.4 ' HE1' ' NH1' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -66.56 -25.92 66.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 179.922 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -67.51 -65.58 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -60.97 -35.65 77.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.41 -29.9 66.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.886 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 39.3 ttp -65.63 -51.13 61.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.06 -41.27 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mp -75.83 -24.65 55.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.732 ' O ' HG23 ' B' ' 119' ' ' VAL . 8.4 t80 -63.74 -55.09 25.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -71.14 -39.55 71.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -25.67 68.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -91.8 -39.11 11.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.732 HG23 ' O ' ' B' ' 115' ' ' TYR . 45.0 t -58.85 -31.29 44.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.148 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.531 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -61.58 -64.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.662 0.744 . . . . 0.0 110.889 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.531 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.76 -50.61 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -63.82 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.63 -30.35 1.46 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.502 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.61 -45.0 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.815 0.34 . . . . 0.0 110.907 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -74.56 -35.78 63.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.37 47.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.55 ' NH1' ' HE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -65.57 -36.83 84.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.876 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.47 -50.72 50.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 2.8 ttp85 -64.14 -34.44 78.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.38 70.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -56.67 -50.04 73.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.97 70.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.11 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -68.75 -49.98 54.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.03 -36.76 78.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.71 -52.06 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.47 -49.51 68.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.556 ' O ' HD23 ' B' ' 163' ' ' LEU . 6.2 mt -56.8 -48.03 78.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.82 -40.12 91.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 92.5 m -57.47 -46.69 83.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.141 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -76.49 -35.73 58.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.76 62.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.78 -62.17 6.5 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.571 0.7 . . . . 0.0 111.108 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.6 Cg_endo -69.79 -42.24 3.54 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.663 2.242 . . . . 0.0 112.336 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -60.81 -33.55 73.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.4 t -61.49 -46.22 90.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.821 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -62.41 -48.9 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.96 -51.87 67.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 11.3 tp -61.2 -49.19 78.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -62.31 -34.56 76.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.7 -34.77 79.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -47.11 57.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.0 tp -70.17 -51.12 33.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.08 -45.12 75.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.3 -34.81 70.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.125 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -32.5 71.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.886 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.421 ' O ' HD12 ' B' ' 178' ' ' LEU . 4.9 tp -71.76 -50.22 31.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -67.35 -43.21 82.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.893 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.39 90.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.079 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 54.9 tp -60.03 -38.28 82.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -69.67 -32.22 70.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -55.13 35.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.885 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.62 -26.15 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.14 -33.75 38.36 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.481 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.12 -32.8 36.38 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.502 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.17 42.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.116 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -73.03 -34.29 66.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.836 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.71 87.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.02 -49.39 37.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.119 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.06 -48.7 77.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.42 -43.77 92.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.892 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 193' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 197' ' ' THR . 85.0 t60 -53.46 -50.42 65.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.851 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.03 -31.17 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.082 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.63 -49.24 19.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.79 83.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.091 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 197' ' ' THR . . . . . 0.481 HG23 ' O ' ' B' ' 193' ' ' HIS . 21.2 p -63.12 -47.45 82.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.168 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -35.94 80.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.87 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.65 -45.89 88.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.844 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.62 -30.28 65.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -50.94 71.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.836 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 54.1 m -68.14 -50.07 57.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.164 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.64 -53.93 48.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.953 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 66.7 m -54.75 -36.07 64.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.868 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.67 -47.77 83.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.17 -28.03 48.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.9 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.12 63.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.503 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -60.13 -62.66 5.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.524 0.678 . . . . 0.0 110.927 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.3 Cg_endo -69.81 -27.06 26.72 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.666 2.244 . . . . 0.0 112.338 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.92 -30.88 56.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.094 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.08 -37.41 66.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -53.89 -50.81 65.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -30.92 61.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.65 -51.57 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.898 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -37.57 82.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.68 -49.07 76.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.496 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.88 -29.51 73.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.49 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.03 -32.79 74.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.939 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.3 mp -52.18 -61.74 4.07 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.609 0.719 . . . . 0.0 110.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.77 -43.69 2.5 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.671 2.247 . . . . 0.0 112.325 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 217' ' ' GLY . 54.6 t -57.27 -53.86 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.106 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.5 -33.55 71.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.566 ' O ' HG23 ' B' ' 227' ' ' VAL . 1.8 tt0 -64.93 -35.91 82.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.889 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 47.8 t -61.97 -48.3 80.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -68.13 -41.07 82.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.8 -45.49 86.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.887 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 223' ' ' GLU . 27.3 t -56.71 -41.65 75.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.105 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.02 -50.07 75.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.828 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -38.15 85.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' B' ' 233' ' ' LEU . 0.4 OUTLIER -62.07 -35.85 79.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.47 -30.53 67.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.83 -51.41 55.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.09 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' B' ' 230' ' ' LEU . 0.8 OUTLIER -69.94 -41.15 74.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.26 -43.55 97.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.866 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.22 -47.51 76.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -54.03 -39.2 65.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.92 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 12.9 m -66.96 -44.68 79.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.164 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -55.6 31.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.874 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.2 -49.08 78.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.551 HD13 ' O ' ' B' ' 240' ' ' LEU . 0.4 OUTLIER -57.83 -39.78 78.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.9 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 52.8 t30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.783 ' O ' HG23 ' A' ' 79' ' ' THR . 9.3 tp -62.33 -55.4 28.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.26 -33.28 75.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -44.37 81.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.17 -37.48 63.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 75' ' ' LEU . 36.3 p -61.84 -21.04 64.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.099 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.09 -31.7 8.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.82 -29.85 43.01 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.466 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 82' ' ' LEU . 2.0 tm? -51.17 -35.25 35.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.845 0.355 . . . . 0.0 110.947 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -50.1 74.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.92 -40.87 95.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -47.41 85.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -40.79 98.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.86 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.409 ' HA ' HD12 ' A' ' 90' ' ' LEU . 2.9 m -58.32 -50.68 72.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.866 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -45.27 95.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.92 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.718 ' O ' HG23 ' A' ' 93' ' ' VAL . 1.0 OUTLIER -56.52 -48.01 78.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 87' ' ' SER . 8.8 mt -57.5 -51.61 68.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.15 -47.86 65.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -63.74 -36.8 85.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.852 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.718 HG23 ' O ' ' A' ' 89' ' ' ASP . 77.6 t -65.8 -32.11 56.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.087 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -74.94 -54.28 7.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.39 71.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.118 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.89 -35.94 42.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.56 -44.79 85.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.118 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.548 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.4 mt-30 -43.81 -65.18 0.62 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.584 0.707 . . . . 0.0 110.894 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.3 Cg_endo -69.71 -26.22 28.02 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.341 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -52.93 -58.48 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' B' ' 160' ' ' ARG . 1.3 pp -54.83 -27.84 45.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -43.81 85.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.87 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -71.97 -37.26 69.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.68 -53.23 58.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.894 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -42.86 98.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -62.56 -28.05 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.89 -45.79 60.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -24.01 64.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -66.75 -65.22 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.62 -35.47 77.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -71.1 -29.77 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -64.42 -51.29 63.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.883 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.48 -41.02 98.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.69 -24.12 56.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 119' ' ' VAL . 7.5 t80 -63.68 -55.76 20.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -63.44 -24.88 68.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.892 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -92.73 -32.99 14.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 115' ' ' TYR . 42.6 t -62.6 -32.07 54.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.158 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 9.4 tt0 -63.28 -61.7 6.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.3 Cg_endo -69.77 -51.21 0.4 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.702 2.268 . . . . 0.0 112.329 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.68 -62.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.937 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.72 -30.72 1.61 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.474 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.79 -43.73 53.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.804 0.335 . . . . 0.0 110.855 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -37.4 64.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -48.99 67.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.9 tpp85 -67.77 -38.4 83.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.868 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -70.42 -50.87 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -38.06 89.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.839 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -62.53 -43.74 98.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.058 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -60.96 -51.25 70.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.857 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.02 -29.97 69.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.117 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -67.85 -51.07 52.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 152' ' ' ALA . 8.2 p -65.84 -39.47 84.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.141 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.61 -52.56 61.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.82 -48.3 74.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.108 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -42.57 78.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.514 ' HB3' HD13 ' B' ' 101' ' ' LEU . 1.5 mpt_? -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.832 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.8 -47.49 82.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.112 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -78.83 -35.51 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.8 tt -71.68 -15.4 62.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.25 -62.69 5.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 0.0 111.142 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.76 -40.81 4.89 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 166' ' ' TYR . . . . . 0.48 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 14.4 t80 -61.92 -34.64 76.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -61.27 -46.19 91.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.874 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.54 -48.95 78.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.889 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.08 -52.01 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.48 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 12.4 tp -59.58 -50.14 75.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ARG . . . . . 0.528 HH21 HG11 ' B' ' 93' ' ' VAL . 7.2 mmm180 -63.71 -34.38 77.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.9 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -62.73 -35.38 79.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.19 -50.82 24.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.96 -51.72 56.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.916 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.91 -44.83 74.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.061 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.71 -35.09 70.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -65.84 -33.1 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 178' ' ' LEU . 1.4 tp -73.8 -51.06 17.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.74 -50.33 65.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.83 -47.74 79.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.119 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 59.1 tp -56.81 -40.03 75.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -65.94 -32.73 74.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -55.0 37.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -67.78 -26.13 65.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.9 -33.95 36.93 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.491 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.86 36.17 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.462 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.76 43.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.766 0.317 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -73.27 -35.89 66.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.29 -37.44 85.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.96 -49.01 41.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.164 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -50.75 71.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.91 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.12 -42.22 85.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -53.95 -49.49 68.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.12 70.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.56 -49.91 17.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.26 79.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' THR . . . . . 0.93 HG23 HD13 ' B' ' 240' ' ' LEU . 59.3 m -64.21 -47.79 78.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.147 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -36.74 80.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.857 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -58.93 -43.8 91.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.34 -31.02 65.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -50.94 71.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 23.1 p -67.72 -50.41 57.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.113 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.59 -52.69 61.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 27.5 t -55.23 -35.84 65.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.848 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.87 -48.07 82.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -29.18 50.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.43 -21.55 63.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.111 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.497 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 1.8 mtpp -59.86 -62.54 5.69 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.615 0.722 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.71 -27.26 26.92 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 0.0 112.343 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.5 -31.85 57.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.121 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.495 ' C ' HD13 ' A' ' 211' ' ' LEU . 3.0 tm? -72.8 -37.46 67.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.85 -51.33 63.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.78 61.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.97 -50.8 70.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.945 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.23 -37.48 85.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.829 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -56.52 -48.31 77.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.926 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.538 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.81 -28.39 73.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.508 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 23.3 tp -66.07 -33.33 75.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.83 0.348 . . . . 0.0 110.931 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.9 tp -49.98 -60.13 5.69 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 0.0 110.911 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.1 Cg_endo -69.77 -39.56 6.34 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.692 2.261 . . . . 0.0 112.345 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.7 t -58.35 -54.49 32.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.02 -34.88 73.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 227' ' ' VAL . 10.2 tt0 -64.85 -35.17 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.882 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.03 -48.54 79.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.85 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -40.76 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.862 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.21 -47.7 78.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 223' ' ' GLU . 37.7 t -56.79 -40.17 69.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.153 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.64 -50.18 74.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -61.34 -38.65 87.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.885 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.774 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -63.43 -35.28 79.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.896 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 8.8 m -69.9 -30.15 67.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.9 -50.96 45.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.11 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.774 HD11 HD13 ' A' ' 230' ' ' LEU . 1.0 OUTLIER -69.25 -42.05 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.0 -38.82 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.66 -47.3 63.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 236' ' ' TYR . . . . . 0.699 ' CZ ' HD11 ' A' ' 240' ' ' LEU . 11.1 t80 -54.07 -39.23 66.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.892 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' O ' ' A' ' 233' ' ' LEU . 36.5 p -69.27 -45.63 69.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.149 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.41 -54.3 42.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.92 -36.3 81.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.877 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.939 HD13 HG23 ' B' ' 197' ' ' THR . 9.5 mt -57.57 -40.94 80.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.777 ' O ' HG23 ' B' ' 79' ' ' THR . 9.3 tp -62.2 -55.42 28.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -33.29 75.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.887 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.909 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.09 -37.94 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' THR . . . . . 0.777 HG23 ' O ' ' B' ' 75' ' ' LEU . 36.8 p -61.33 -20.94 63.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.108 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.08 -31.8 8.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.74 -29.9 42.45 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.682 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.9 tm? -51.17 -35.33 35.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 110.945 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -50.12 74.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.79 -40.95 96.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.02 -47.73 84.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -40.56 98.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' SER . . . . . 0.412 ' HA ' HD12 ' B' ' 90' ' ' LEU . 2.9 m -58.24 -50.52 73.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -45.47 93.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.882 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.41 -48.27 77.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.896 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' B' ' 87' ' ' SER . 8.0 mt -57.38 -51.6 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.86 -47.87 64.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -64.14 -36.08 82.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.3 t -66.44 -32.16 56.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 2.2 tmtt? -75.28 -55.27 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.73 70.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.135 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -78.85 -36.68 41.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.5 t -52.76 -50.59 41.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.573 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mt-30 -40.77 -66.75 0.35 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.533 0.682 . . . . 0.0 110.926 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.9 Cg_endo -69.78 -21.72 33.0 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.675 2.25 . . . . 0.0 112.349 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -52.89 -56.14 18.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.875 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.514 HD13 ' HB3' ' A' ' 160' ' ' ARG . 1.2 pp -61.19 -28.19 68.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.907 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -45.9 90.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.844 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -73.09 -38.0 66.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.09 -53.5 56.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.874 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -42.66 99.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.873 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -61.84 -26.99 68.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -72.79 -47.94 42.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -26.67 68.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.24 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.11 -35.52 77.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -71.22 -29.46 65.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -64.44 -50.67 66.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -64.19 -40.22 95.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.26 -24.76 57.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.739 ' O ' HG23 ' B' ' 119' ' ' VAL . 18.1 t80 -65.18 -55.66 17.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.916 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -39.47 83.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -66.2 -24.95 66.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -92.24 -37.79 12.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.923 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.739 HG23 ' O ' ' B' ' 115' ' ' TYR . 52.1 t -60.4 -31.86 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.125 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.516 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.4 mt-10 -61.85 -63.86 3.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 0.0 110.872 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.73 -50.39 0.47 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.276 . . . . 0.0 112.363 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -63.89 1.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.99 -30.16 1.67 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.5 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.31 -44.34 37.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.866 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -44.36 61.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.859 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -51.78 62.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -61.62 -42.04 98.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.68 -50.49 62.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -33.78 75.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.63 -50.75 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.074 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -55.98 -50.34 71.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.881 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.66 -30.87 70.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.109 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -67.92 -50.63 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.35 -39.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -54.66 -52.28 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.97 -48.27 74.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.062 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.76 -42.38 79.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 160' ' ' ARG . . . . . 0.468 ' HB3' HD13 ' A' ' 101' ' ' LEU . 7.7 mpt_? -66.41 -39.18 88.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.79 -47.29 82.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.155 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -79.03 -35.35 42.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.829 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.9 tt -71.76 -15.93 62.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.887 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.65 -62.66 5.52 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.605 0.717 . . . . 0.0 111.122 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.75 -40.15 5.67 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 0.0 112.356 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 166' ' ' TYR . . . . . 0.413 ' CZ ' HD22 ' B' ' 170' ' ' LEU . 14.4 t80 -62.71 -34.32 76.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.892 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -61.35 -46.45 90.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.86 -48.16 81.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.44 -51.86 63.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' B' ' 166' ' ' TYR . 12.4 tp -60.08 -49.56 77.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 171' ' ' ARG . . . . . 0.414 HH21 HG11 ' A' ' 93' ' ' VAL . 7.2 mmm180 -63.89 -34.29 77.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.76 -35.73 80.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.03 -50.82 25.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -51.58 58.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.25 -44.31 75.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.113 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.82 -35.05 69.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -65.25 -33.86 77.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.431 ' O ' HD12 ' B' ' 178' ' ' LEU . 1.5 tp -73.52 -50.53 20.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.925 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.32 -47.55 76.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -60.04 -48.74 80.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 57.9 tp -57.3 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -70.36 -33.7 71.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -54.16 47.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.846 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -67.95 -25.95 65.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.85 -33.87 36.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.516 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.03 -32.19 34.45 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.46 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.32 -25.51 42.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.327 . . . . 0.0 111.102 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 8.3 ttp180 -73.01 -36.81 67.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.897 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -37.26 83.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.935 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.91 -48.82 42.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.094 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -51.29 69.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -57.91 -42.48 84.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -53.52 -49.67 67.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.85 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.29 -31.05 70.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -75.51 -49.87 17.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.909 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.39 -35.44 79.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.118 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 197' ' ' THR . . . . . 0.939 HG23 HD13 ' A' ' 240' ' ' LEU . 56.5 m -64.02 -47.72 79.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -36.76 80.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.892 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -58.97 -43.57 91.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.51 -31.05 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -50.87 71.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 23.2 p -67.66 -50.41 57.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 26.7 tp -54.68 -52.65 61.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.882 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 27.7 t -55.25 -35.79 65.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.839 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.96 -48.04 82.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.87 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.18 50.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.58 -21.41 63.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 1.8 mtpp -59.98 -62.53 5.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.555 0.693 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.5 Cg_endo -69.78 -27.24 26.61 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.686 2.257 . . . . 0.0 112.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.58 -31.87 57.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' B' ' 211' ' ' LEU . 3.0 tm? -72.66 -37.5 67.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.94 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.88 -51.17 64.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.77 61.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.81 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -62.09 -50.85 70.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.15 -37.49 85.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.842 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -56.45 -48.37 77.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.563 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.76 -28.37 73.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.494 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 23.4 tp -66.12 -33.32 75.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.9 tp -50.07 -60.03 5.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.598 0.713 . . . . 0.0 110.918 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.9 Cg_endo -69.76 -39.63 6.28 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.662 2.241 . . . . 0.0 112.369 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.36 -54.51 31.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.161 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.01 -34.87 73.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.536 ' O ' HG23 ' B' ' 227' ' ' VAL . 10.2 tt0 -64.9 -35.11 80.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.863 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.09 -48.52 79.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.854 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -40.87 76.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.927 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.16 -47.75 78.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.902 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.536 HG23 ' O ' ' B' ' 223' ' ' GLU . 37.7 t -56.74 -40.21 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.136 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.18 74.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -61.35 -38.6 87.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.785 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -63.38 -35.45 80.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 8.6 m -69.78 -30.22 67.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.86 45.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.122 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.785 HD11 HD13 ' B' ' 230' ' ' LEU . 1.0 OUTLIER -69.28 -42.12 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -38.73 92.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.892 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.71 -47.26 63.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 236' ' ' TYR . . . . . 0.689 ' CZ ' HD11 ' B' ' 240' ' ' LEU . 11.3 t80 -54.17 -39.13 66.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 237' ' ' THR . . . . . 0.717 HG23 ' O ' ' B' ' 233' ' ' LEU . 35.9 p -69.32 -45.63 69.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.135 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -54.47 -54.24 43.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.84 -36.35 82.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.931 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.93 HD13 HG23 ' A' ' 197' ' ' THR . 9.4 mt -57.52 -40.89 79.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.881 0.372 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.5 -57.04 10.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.12 -33.79 58.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.63 -52.85 55.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -27.83 65.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.0 m -58.61 -26.9 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -50.87 -47.44 60.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.93 -29.26 19.52 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.514 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.1 tm? -49.83 -43.21 48.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 0.0 110.933 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.9 ttt180 -58.03 -49.42 76.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.79 88.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.897 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.26 -49.95 72.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -42.54 81.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.77 -50.5 73.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.838 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -43.56 89.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -57.16 -48.49 78.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.2 tp -57.01 -49.87 74.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.28 -48.0 71.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.43 -35.98 82.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 64.9 t -65.39 -32.83 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.092 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -74.5 -52.63 11.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.76 -32.58 72.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -77.98 -33.57 51.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -58.98 -43.29 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.537 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.4 OUTLIER -43.95 -64.93 0.67 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.59 0.709 . . . . 0.0 110.911 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.69 -30.31 22.81 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 0.0 112.371 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -58.25 -27.44 63.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -50.71 28.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -33.79 76.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.48 -48.12 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.838 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -56.59 -52.57 64.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -45.7 84.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -62.9 -22.71 66.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -72.95 -47.73 42.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -30.0 70.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -56.23 15.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.97 -34.39 71.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -69.51 -34.41 74.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 23.5 ttp -68.84 -54.29 16.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -64.29 -35.78 81.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.67 -26.06 54.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.7 t80 -62.81 -55.35 27.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -35.14 62.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 tt0 -68.02 -23.95 65.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -85.82 -43.85 12.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 60.6 t -59.39 -32.47 48.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.55 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 mm-40 -56.54 -65.58 1.57 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.663 0.744 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.74 -52.3 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.637 2.224 . . . . 0.0 112.357 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.24 -65.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.27 -33.95 2.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -76.22 -44.77 36.14 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.88 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -66.86 -43.52 83.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -47.13 73.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -64.99 -42.34 94.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.84 -53.08 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.26 -38.53 83.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.862 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.75 -42.02 99.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -60.21 -53.26 59.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.01 50.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -56.95 -46.03 82.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 5.1 t -59.33 -52.5 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.172 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.36 -52.37 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.845 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.38 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.134 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.19 -44.26 87.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -67.54 -43.99 79.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 23.9 m -55.84 -42.1 75.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.171 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 -33.89 30.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.13 -23.19 62.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -55.49 -62.57 4.24 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.577 0.703 . . . . 0.0 111.043 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.0 Cg_endo -69.72 -43.13 2.87 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.709 2.273 . . . . 0.0 112.324 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -60.9 -28.99 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 12.7 t -59.67 -51.82 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.818 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.29 -48.93 68.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.65 -51.58 68.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.472 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.3 tm? -61.06 -46.57 90.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.875 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -42.96 81.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -34.46 78.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -49.76 57.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -50.58 45.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.94 -35.58 64.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.34 -34.32 55.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.118 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -48.28 81.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.6 pp -68.83 -49.18 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 179' ' ' GLU . . . . . 0.513 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.2 OUTLIER -58.76 -50.53 73.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.59 87.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.136 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 52.7 tp -67.75 -34.85 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -31.28 66.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.23 -55.73 27.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.96 -26.27 66.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.85 39.08 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.497 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 186' ' ' GLY . . . . . 0.43 ' HA2' HD23 ' A' ' 189' ' ' LEU . . . -52.08 -33.89 38.21 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.53 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.06 -23.83 38.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -32.53 67.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.43 HD23 ' HA2' ' A' ' 186' ' ' GLY . 1.4 pp -63.14 -36.92 85.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.54 -49.53 32.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.13 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -44.89 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.856 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -60.4 -46.82 88.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.887 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -49.23 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.898 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.89 -31.69 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.46 -49.31 16.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.68 78.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.129 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.9 m -66.32 -47.61 72.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -69.9 -36.24 75.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.44 84.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.872 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 mp -71.23 -30.13 65.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 -51.33 69.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.836 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.66 -50.37 51.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.133 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.97 -54.92 32.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 43.2 m -54.62 -35.66 63.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.827 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.56 -48.35 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.09 -27.8 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.24 -22.01 64.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.501 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 9.9 mmtt -61.21 -63.07 4.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.567 0.699 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 54.6 Cg_endo -69.69 -26.92 27.43 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.717 2.278 . . . . 0.0 112.354 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.71 -32.88 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -36.65 73.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -54.32 -50.62 66.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.48 -30.49 63.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.14 -48.41 78.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 215' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 219' ' ' LEU . 0.9 OUTLIER -70.39 -41.97 72.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.7 -25.76 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.955 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.558 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -79.04 -44.49 9.8 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.73 -27.54 68.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.501 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 2.7 mp -50.85 -62.97 2.18 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 0.0 110.892 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.0 Cg_endo -69.69 -44.63 2.01 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.755 2.304 . . . . 0.0 112.328 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 217' ' ' GLY . 90.5 t -55.88 -54.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.133 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.85 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -66.37 -40.12 89.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -48.06 83.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.872 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.91 -38.06 82.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 223' ' ' GLU . 54.7 t -56.78 -49.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.145 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -50.75 72.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.832 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.38 -37.98 82.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.2 -40.59 97.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.28 72.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.91 -44.93 68.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.697 HD23 ' N ' ' A' ' 234' ' ' GLU . 0.0 OUTLIER -61.27 -38.99 88.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 234' ' ' GLU . . . . . 0.697 ' N ' HD23 ' A' ' 233' ' ' LEU . 0.7 OUTLIER -74.6 -35.4 62.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -68.05 -48.87 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -63.74 -41.01 98.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.97 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 237' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 233' ' ' LEU . 37.9 p -70.75 -45.88 63.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.078 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -56.22 -55.07 37.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.83 79.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 30.8 mt -57.77 -37.72 74.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.908 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.891 0.376 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -57.01 10.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.06 -33.73 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.885 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.75 -52.85 54.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -27.8 65.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -58.6 -26.84 64.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -51.02 -47.67 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -29.26 18.86 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.528 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.559 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.1 tm? -49.95 -42.98 49.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -58.15 -49.47 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -44.77 88.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.908 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.21 -50.14 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.26 -42.28 81.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.856 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.88 -50.41 74.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -43.64 90.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.704 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.88 -48.87 77.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 39.1 tp -57.04 -49.49 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.955 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -54.31 -47.83 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -36.11 82.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 89' ' ' ASP . 69.6 t -65.41 -32.7 59.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.099 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -75.09 -52.96 9.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.14 73.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -78.26 -33.83 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.58 -47.53 78.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.139 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.558 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.4 OUTLIER -42.61 -66.23 0.45 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.619 0.723 . . . . 0.0 110.942 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.2 Cg_endo -69.77 -29.6 23.58 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.695 2.264 . . . . 0.0 112.303 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 100' ' ' TYR . . . . . 0.435 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.5 t80 -58.0 -26.15 62.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.89 -49.43 17.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.932 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.15 -33.55 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.86 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -47.56 63.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -55.83 -52.94 62.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.887 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -47.28 79.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -60.37 -22.33 63.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -74.11 -48.47 29.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.871 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -31.92 73.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.6 -55.45 20.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.96 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -70.7 -34.57 72.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -69.79 -33.0 71.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 20.5 ttp -69.65 -54.4 14.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.64 -35.76 82.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -76.29 -25.98 55.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.738 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.7 t80 -62.92 -55.19 28.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -33.86 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.449 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 2.3 tt0 -69.37 -23.33 63.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -87.47 -44.99 10.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 115' ' ' TYR . 58.9 t -59.9 -32.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.122 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.545 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mm-40 -57.16 -65.35 1.78 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.3 Cg_endo -69.86 -51.4 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.66 2.24 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -65.89 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.942 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.32 -34.17 1.53 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.504 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tp10 -77.14 -47.01 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 110.877 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.32 -47.69 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -51.46 63.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -60.04 -44.13 94.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.21 -52.22 50.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.95 -33.33 73.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.429 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.36 -46.42 83.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 9.7 ttp180 -58.9 -52.71 64.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.51 -54.88 42.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -57.9 -42.6 85.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.6 t -61.08 -51.47 72.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.27 -50.87 28.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.32 -44.65 87.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.093 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -57.93 -41.61 83.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 -67.89 -45.4 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 23.8 m -55.94 -41.23 74.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -81.54 -33.98 31.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.833 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.67 -23.38 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.822 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -55.52 -62.42 4.51 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.546 0.689 . . . . 0.0 111.123 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.822 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.3 Cg_endo -69.77 -41.29 4.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.679 2.253 . . . . 0.0 112.38 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -62.56 -29.34 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 7.7 t -59.62 -51.47 69.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.79 -49.11 69.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.95 -51.57 68.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' B' ' 170' ' ' LEU . 2.4 tm? -60.98 -46.68 89.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -42.62 81.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -34.65 78.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -48.8 63.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.875 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -50.59 40.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.947 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 175' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.22 -35.23 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.091 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.33 -34.31 55.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.103 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -48.28 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.904 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.509 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.6 pp -68.99 -48.86 62.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.937 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 179' ' ' GLU . . . . . 0.509 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.2 OUTLIER -58.72 -50.51 73.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.08 89.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 52.5 tp -67.68 -34.84 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -31.77 66.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -55.12 -55.59 29.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.77 -26.21 66.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.4 -33.67 40.19 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 186' ' ' GLY . . . . . 0.434 ' HA2' HD23 ' B' ' 189' ' ' LEU . . . -52.01 -34.08 38.03 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.465 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.04 -23.79 38.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.733 0.301 . . . . 0.0 111.097 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -32.52 67.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.434 HD23 ' HA2' ' B' ' 186' ' ' GLY . 1.4 pp -63.08 -37.01 85.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.51 -49.57 31.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.053 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -44.59 90.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.62 -46.96 88.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.43 -49.22 67.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.61 70.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.078 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.49 -49.24 17.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.4 -34.89 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.1 m -65.95 -47.64 73.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.173 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -69.94 -36.23 75.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.885 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.37 84.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.33 -30.07 65.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.83 -51.24 69.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.856 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.75 -50.25 52.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.163 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.17 -54.94 32.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.869 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 43.3 m -54.53 -35.71 63.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.57 -48.31 81.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.07 -27.87 48.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.97 64.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.075 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 9.8 mmtt -61.28 -63.13 4.67 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.597 0.713 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.8 Cg_endo -69.82 -26.7 27.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.03 57.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.34 -36.48 74.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -54.34 -50.31 67.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -30.54 63.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.17 -48.32 79.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 215' ' ' ARG . . . . . 0.47 ' O ' HD13 ' B' ' 219' ' ' LEU . 0.9 OUTLIER -70.42 -42.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.81 -25.59 68.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.54 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -79.03 -44.62 9.68 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.456 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.64 -27.54 69.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.816 0.341 . . . . 0.0 110.93 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 2.6 mp -50.86 -62.92 2.23 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.593 0.711 . . . . 0.0 110.902 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.2 Cg_endo -69.81 -44.51 2.0 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.672 2.248 . . . . 0.0 112.323 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 217' ' ' GLY . 90.3 t -55.94 -54.19 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.132 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.88 71.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.915 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.746 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.5 mt-10 -66.33 -40.08 89.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -48.05 83.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.847 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -40.19 93.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 226' ' ' LYS . . . . . 0.404 ' O ' HD23 ' B' ' 230' ' ' LEU . 0.5 OUTLIER -67.96 -38.07 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.746 HG23 ' O ' ' B' ' 223' ' ' GLU . 53.2 t -56.71 -49.09 79.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -50.75 72.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -60.42 -37.93 82.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.404 HD23 ' O ' ' B' ' 226' ' ' LYS . 1.6 mm? -63.24 -40.63 97.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.886 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -31.26 72.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.865 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.92 -44.98 68.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.678 HD23 ' N ' ' B' ' 234' ' ' GLU . 0.0 OUTLIER -61.2 -39.04 88.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 234' ' ' GLU . . . . . 0.678 ' N ' HD23 ' B' ' 233' ' ' LEU . 0.7 OUTLIER -74.59 -35.51 62.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.827 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.96 -48.86 64.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.913 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -63.75 -41.09 98.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 237' ' ' THR . . . . . 0.423 HG23 ' O ' ' B' ' 233' ' ' LEU . 38.0 p -70.69 -45.83 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.123 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -56.22 -55.06 37.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.81 79.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.74 -37.75 74.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.906 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.855 0.359 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.6 -56.43 22.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.58 -34.45 74.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.929 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -56.48 -51.61 67.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -72.14 -32.12 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 82' ' ' LEU . 95.6 m -65.86 -23.69 66.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.135 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.409 ' O ' HD23 ' A' ' 82' ' ' LEU . 5.9 tt0 -50.04 -32.01 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.89 -27.85 14.84 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.592 HD23 ' H ' ' A' ' 83' ' ' ARG . 1.1 pt? -49.15 -34.71 14.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.79 0.329 . . . . 0.0 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.592 ' H ' HD23 ' A' ' 82' ' ' LEU . 3.4 ttm-85 -61.81 -49.88 74.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.12 -43.79 95.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.69 -49.69 74.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.18 -41.55 84.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.918 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -50.1 74.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.881 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.72 -44.29 90.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.24 -47.7 77.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.859 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 37.1 tp -57.39 -50.29 73.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.872 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -47.87 69.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.881 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -64.12 -34.86 79.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 74.4 t -65.54 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -74.71 -52.88 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.833 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.72 -33.11 73.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.119 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -77.37 -33.25 55.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.48 -43.93 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.143 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -43.87 -65.03 0.64 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.586 0.708 . . . . 0.0 110.897 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.75 -31.29 20.84 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.669 2.246 . . . . 0.0 112.375 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.409 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.6 t80 -58.18 -25.54 61.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.19 -50.17 35.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.95 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -64.36 -34.87 79.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.91 -52.39 65.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -64.49 -43.89 92.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -64.38 -22.89 67.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -49.42 34.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' TRP . . . . . 0.401 ' CD1' ' HD2' ' B' ' 149' ' ' ARG . 0.5 OUTLIER -65.13 -29.06 69.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -56.86 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.878 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -70.99 -34.43 71.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.892 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.01 -34.3 75.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -68.89 -54.03 17.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.82 -35.58 81.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.866 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.62 -26.65 55.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -62.13 -55.24 30.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.945 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -34.01 61.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.86 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 48.2 tt0 -68.17 -23.83 64.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmtt -86.73 -44.33 11.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 55.6 t -59.0 -32.65 48.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.1 mt-10 -56.91 -65.62 1.61 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.666 0.746 . . . . 0.0 110.896 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.1 Cg_endo -69.79 -52.19 0.34 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 0.0 112.302 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.66 -64.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.19 -32.39 2.51 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.514 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -44.85 34.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.868 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -68.06 -41.91 81.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -46.25 74.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.894 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.427 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.5 tpp180 -66.49 -41.59 88.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.73 -52.86 18.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -59.54 -39.87 85.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.77 -41.15 99.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.139 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -52.63 64.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.21 45.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.123 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -56.29 -45.32 80.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.72 -52.17 64.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.088 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.03 -52.35 15.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.881 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.2 93.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.103 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.01 -44.23 87.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.3 -44.59 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 24.3 m -55.58 -42.11 74.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.125 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -81.86 -32.61 31.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.799 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -69.98 -24.51 63.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.929 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.842 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.38 -62.94 3.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.842 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.4 Cg_endo -69.78 -43.36 2.69 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.692 2.261 . . . . 0.0 112.348 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 166' ' ' TYR . . . . . 0.674 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.9 t80 -58.4 -33.4 69.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.876 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -52.11 64.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -67.06 -31.95 72.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.881 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -66.79 -51.15 59.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.674 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -58.46 -49.76 76.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -36.31 72.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.853 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.82 -52.63 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.53 -47.74 77.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.84 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.1 -51.43 69.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.61 -35.79 63.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.083 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.27 50.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.066 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -48.32 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.868 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.7 pp -67.42 -49.71 62.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' A' ' 178' ' ' LEU . 2.2 pp20? -59.71 -34.09 72.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.27 -45.3 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.081 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.57 -40.97 76.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -75.61 -32.2 60.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -56.82 15.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.844 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.75 -26.33 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.905 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.29 -34.39 40.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.53 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.67 38.77 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.1 39.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.78 0.324 . . . . 0.0 111.08 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -73.56 -32.49 64.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.872 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -37.91 89.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.2 -49.92 31.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.087 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -63.87 -42.1 97.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.1 -45.27 92.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -54.47 -47.9 72.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.829 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.65 72.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -76.04 -50.6 14.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.34 93.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.119 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' THR . . . . . 0.547 HG21 HD13 ' B' ' 240' ' ' LEU . 83.6 m -61.43 -47.48 85.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -36.51 83.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.853 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.57 -44.66 89.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.842 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -71.85 -30.09 65.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.6 m -57.44 -51.37 69.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -51.06 50.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.197 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.33 -54.84 34.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 50.7 m -54.53 -35.23 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.09 -47.8 83.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -77.71 -30.28 51.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 207' ' ' ALA . . . . . 0.479 ' O ' HD23 ' A' ' 211' ' ' LEU . . . -68.22 -22.13 64.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.126 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.514 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -59.14 -63.37 4.26 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 110.904 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.514 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.75 -24.73 29.4 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.722 2.282 . . . . 0.0 112.348 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.2 -32.5 59.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.092 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.506 HD13 HD22 ' A' ' 214' ' ' LEU . 1.9 mm? -73.12 -35.88 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -53.85 -51.6 63.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.15 -30.85 58.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.506 HD22 HD13 ' A' ' 211' ' ' LEU . 2.9 tt -61.89 -51.26 68.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.949 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.48 -37.13 84.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -56.74 -48.87 76.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.877 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.53 -29.53 74.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.478 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.24 -32.96 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.348 . . . . 0.0 110.921 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -49.81 -61.14 3.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.644 0.735 . . . . 0.0 110.912 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.76 -39.61 6.31 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.663 2.242 . . . . 0.0 112.363 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.8 t -58.0 -54.73 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.21 74.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.679 ' O ' HG23 ' A' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.34 80.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 14.1 m -59.88 -48.19 82.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -43.1 94.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 223' ' ' GLU . 51.6 t -55.76 -43.56 74.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.2 -50.45 73.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -61.09 -38.98 88.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.793 HD22 HD11 ' A' ' 233' ' ' LEU . 3.0 tm? -62.19 -33.39 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -31.43 67.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.795 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.44 -53.05 39.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.119 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 230' ' ' LEU . 0.8 OUTLIER -66.18 -43.3 87.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.941 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.3 -34.65 78.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.55 -49.34 75.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.23 -45.83 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.907 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.36 -45.95 88.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.15 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.11 -53.89 50.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -45.88 77.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.502 HD13 HG21 ' B' ' 197' ' ' THR . 13.1 tp -56.91 -37.42 71.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.842 179.883 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.876 0.37 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.45 -56.4 22.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.8 -34.31 74.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -56.41 -51.54 67.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -72.23 -32.33 66.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' B' ' 82' ' ' LEU . 95.5 m -65.58 -23.54 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.153 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.22 -32.14 15.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -27.98 14.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.435 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.594 HD23 ' H ' ' B' ' 83' ' ' ARG . 1.1 pt? -49.09 -34.61 14.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.314 . . . . 0.0 110.892 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ARG . . . . . 0.594 ' H ' HD23 ' B' ' 82' ' ' LEU . 3.5 ttm-85 -61.85 -49.96 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.854 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.16 -43.75 95.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.67 -49.62 74.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.41 -41.34 84.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.75 -44.37 90.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.714 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.1 -47.91 77.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.54 -49.88 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.924 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.46 -47.58 69.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -64.52 -34.93 79.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 89' ' ' ASP . 71.0 t -65.52 -32.9 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.129 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -75.36 -53.3 8.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.78 74.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.117 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -77.45 -33.43 54.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -55.31 -47.75 77.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.14 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.565 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -42.28 -66.49 0.41 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.609 0.719 . . . . 0.0 110.91 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.565 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.74 -30.45 22.37 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 100' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.8 t80 -57.5 -25.04 59.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.907 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.42 -49.4 19.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -59.68 -34.7 73.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.874 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -47.49 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -55.99 -52.57 63.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.46 -44.62 90.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -62.71 -22.5 66.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -50.28 22.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.906 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.42 -30.58 71.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -56.44 13.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.42 -34.88 73.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -69.14 -32.52 71.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.913 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' MET . . . . . 0.427 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 2.7 tmm? -69.8 -54.01 15.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.893 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -65.6 -35.43 80.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.18 -26.63 56.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.74 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.4 t80 -62.51 -55.07 30.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.957 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -33.36 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 48.8 tt0 -69.12 -22.78 63.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -88.39 -46.39 9.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.74 HG23 ' O ' ' B' ' 115' ' ' TYR . 56.4 t -58.72 -32.59 46.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.135 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 1.0 OUTLIER -57.5 -65.53 1.74 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.616 0.722 . . . . 0.0 110.871 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.69 -51.66 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.685 2.257 . . . . 0.0 112.338 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -65.37 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.78 -32.0 2.03 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.27 -46.79 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.43 -46.34 73.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -51.96 61.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.401 ' HD2' ' CD1' ' A' ' 108' ' ' TRP . 12.9 tpp180 -60.32 -43.14 96.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.883 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.49 -52.01 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -59.97 -34.07 72.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.406 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.51 -45.27 87.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.115 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.852 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.25 -54.94 39.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.075 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -56.76 -43.87 81.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.862 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.8 t -60.21 -51.34 74.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.48 -51.49 20.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.8 90.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.115 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.08 -42.24 85.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.912 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.55 -45.63 75.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 24.2 m -55.61 -41.52 73.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.145 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -81.51 -32.89 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.25 -24.6 63.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.833 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.23 -62.75 3.46 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.605 0.717 . . . . 0.0 111.089 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.833 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.7 Cg_endo -69.75 -42.37 3.47 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 0.0 112.346 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 166' ' ' TYR . . . . . 0.66 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.3 t80 -59.57 -33.68 71.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.43 -52.0 65.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -66.76 -32.34 73.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.8 -51.0 60.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.66 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.49 -49.57 76.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -36.13 72.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -52.43 62.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.891 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.16 -47.72 78.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.861 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.41 -51.22 70.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.903 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 175' ' ' ALA . . . . . 0.527 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -54.82 -35.45 63.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.12 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.34 50.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -47.94 60.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.8 pp -67.85 -49.55 61.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' B' ' 178' ' ' LEU . 2.1 pp20? -59.57 -34.21 72.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.31 -45.39 47.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.068 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.84 -40.93 76.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -75.64 -32.85 60.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.899 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -56.53 18.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.67 -26.31 60.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.855 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.45 -34.22 41.67 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.457 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.13 -33.71 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.529 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.11 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -73.54 -32.74 64.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -38.15 90.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.15 -49.71 33.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.124 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.97 -41.83 97.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.29 -45.46 91.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.33 -47.75 72.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.881 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.35 -31.55 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.084 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -76.03 -50.52 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.63 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.126 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 197' ' ' THR . . . . . 0.502 HG21 HD13 ' A' ' 240' ' ' LEU . 80.9 m -61.27 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.166 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -36.51 83.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.6 -44.55 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.01 -30.13 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 9.2 m -57.45 -51.24 70.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.835 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -51.02 50.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.137 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.44 -54.84 35.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.875 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 50.3 m -54.69 -35.09 63.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.1 -47.77 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -77.81 -30.4 51.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.883 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 207' ' ' ALA . . . . . 0.483 ' O ' HD23 ' B' ' 211' ' ' LEU . . . -68.19 -22.1 64.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.127 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.519 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -59.15 -63.48 4.12 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.556 0.693 . . . . 0.0 110.911 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.9 Cg_endo -69.81 -24.71 29.12 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.332 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.29 -32.29 58.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 211' ' ' LEU . . . . . 0.498 HD13 HD22 ' B' ' 214' ' ' LEU . 1.8 mm? -73.19 -35.78 66.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -53.78 -51.45 63.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.914 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.16 -30.78 58.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.498 HD22 HD13 ' B' ' 211' ' ' LEU . 2.9 tt -61.95 -51.36 68.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.35 -37.12 84.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -56.76 -48.8 77.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.554 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.55 -29.41 73.98 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.5 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.27 -32.98 74.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.897 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.0 OUTLIER -49.79 -61.13 3.91 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.62 0.724 . . . . 0.0 110.931 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.73 -39.71 6.24 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.707 2.271 . . . . 0.0 112.349 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.06 -54.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.113 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.17 74.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.681 ' O ' HG23 ' B' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.37 80.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 14.0 m -59.86 -48.18 82.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.3 -41.94 96.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -43.15 94.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 223' ' ' GLU . 51.4 t -55.68 -43.49 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.152 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.34 -50.33 74.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -61.13 -39.01 88.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.854 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.755 HD22 HD11 ' B' ' 233' ' ' LEU . 3.0 tm? -62.18 -33.4 74.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.57 -31.34 66.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.06 39.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.143 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.755 HD11 HD22 ' B' ' 230' ' ' LEU . 0.8 OUTLIER -66.13 -43.23 87.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.917 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.34 -34.62 78.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.65 -49.25 75.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.18 -45.96 86.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.953 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.27 -45.97 88.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.119 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.17 -53.84 50.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -45.91 77.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.547 HD13 HG21 ' A' ' 197' ' ' THR . 13.1 tp -56.77 -37.52 71.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.922 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.943 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -45.51 64.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.55 65.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.58 -32.04 65.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.14 -48.53 78.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.37 -45.48 31.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.124 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.57 -30.84 67.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.931 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.42 56.09 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.452 HD11 HD21 ' B' ' 178' ' ' LEU . 8.7 mt -58.89 -35.8 73.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -49.62 77.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -68.6 -48.21 64.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.12 -29.19 69.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.855 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.56 -51.81 13.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.0 p -65.66 -35.88 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -40.63 64.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -61.96 -48.09 81.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.67 -50.94 55.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -58.01 -42.47 85.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.89 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.45 -47.94 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.898 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 97' ' ' VAL . 4.4 t -56.72 -33.16 39.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.114 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -52.32 10.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.87 -35.61 77.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -79.27 -34.92 42.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.429 ' HA ' ' HB2' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -53.51 -44.77 57.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.112 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.56 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -47.67 -65.96 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.58 0.705 . . . . 0.0 110.92 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.56 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.6 Cg_endo -69.71 -24.87 29.42 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.668 2.245 . . . . 0.0 112.347 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.429 ' HB2' ' HA ' ' A' ' 97' ' ' VAL . 2.7 m-30 -61.35 -35.08 76.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -51.66 16.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.943 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.05 -34.27 77.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.62 -47.32 76.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.41 -52.05 67.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -64.73 -47.52 77.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -63.99 -22.68 67.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.908 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -71.11 -48.52 51.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -23.31 57.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -64.99 -60.02 3.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.66 -34.32 73.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.42 -30.51 69.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -71.8 -53.28 13.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.87 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.29 -35.02 79.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 114' ' ' LEU . 3.1 tm? -76.35 -26.19 55.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.71 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.2 t80 -65.65 -54.76 23.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.951 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.87 -33.9 66.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.417 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 22.1 tt0 -70.19 -23.09 62.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -90.3 -45.22 9.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 115' ' ' TYR . 94.5 t -59.98 -32.45 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.139 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.539 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -57.88 -64.68 2.45 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.637 0.732 . . . . 0.0 110.901 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.4 Cg_endo -69.8 -50.94 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.679 2.253 . . . . 0.0 112.32 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -63.54 1.04 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.5 -30.47 4.49 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.496 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.52 -43.32 56.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.328 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.19 -33.96 63.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 2.6 ttt -66.99 -48.94 66.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -38.26 86.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.872 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -71.57 -52.58 17.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.8 mmt-85 -63.0 -38.2 90.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.28 -37.69 88.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -64.04 -49.89 70.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.6 -38.67 70.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.043 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -66.9 -50.74 61.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 152' ' ' ALA . 4.8 p -64.32 -40.62 89.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.418 ' N ' ' CG1' ' A' ' 156' ' ' VAL . 22.4 t0 -52.61 -50.56 62.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.833 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.48 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.099 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.96 -38.73 73.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -68.51 -45.57 71.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.839 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 34.7 m -55.4 -40.98 72.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.77 -34.04 30.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.02 -21.47 62.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -56.44 -62.66 4.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.61 0.719 . . . . 0.0 111.098 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.9 Cg_endo -69.74 -42.23 3.61 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.335 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 166' ' ' TYR . . . . . 0.412 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.5 t80 -55.76 -33.68 64.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -51.58 69.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.834 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.73 -32.69 73.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.864 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -50.05 72.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.412 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -59.21 -49.59 77.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.69 -37.74 76.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.62 -51.79 68.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.44 -38.69 81.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -41.92 75.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -45.45 75.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.25 -34.57 70.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.078 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.86 -37.5 87.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.603 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -68.09 -51.6 44.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.89 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 179' ' ' GLU . . . . . 0.603 ' N ' HD23 ' A' ' 178' ' ' LEU . 10.2 pt-20 -65.93 -40.64 91.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.77 -46.48 77.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -35.88 79.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.898 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -31.84 69.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.888 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -56.15 21.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.865 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.8 -25.76 63.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.53 -31.72 44.67 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.511 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -64.02 -49.88 64.35 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.46 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.68 -21.83 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.322 . . . . 0.0 111.127 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -71.76 -29.11 64.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -49.91 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.914 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.45 -48.95 68.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.115 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -63.37 -51.45 65.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.903 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -54.11 -48.93 70.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.91 69.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.68 -42.4 41.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.922 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.94 -47.7 73.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.137 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 40.0 p -60.07 -46.82 88.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.187 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.88 -35.86 75.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.12 -54.27 46.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -28.7 64.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.53 -51.41 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.817 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -50.85 30.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.71 -57.34 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -54.46 -35.96 63.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.99 -47.84 81.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -27.75 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.31 66.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.524 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.0 OUTLIER -64.61 -63.99 3.17 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.581 0.705 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.524 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.4 Cg_endo -69.77 -26.85 27.13 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.724 2.283 . . . . 0.0 112.298 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.73 -31.75 59.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 5.7 tt -71.2 -40.83 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.65 -51.16 66.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -75.99 -29.81 58.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.851 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -45.78 91.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 215' ' ' ARG . . . . . 0.652 ' O ' HD13 ' A' ' 219' ' ' LEU . 8.4 mtp180 -72.92 -40.03 65.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -68.06 -25.12 65.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -80.7 -49.84 5.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -27.99 69.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.846 0.355 . . . . 0.0 110.925 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.652 HD13 ' O ' ' A' ' 215' ' ' ARG . 1.4 mp -50.51 -63.43 1.85 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.596 0.712 . . . . 0.0 110.948 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.2 Cg_endo -69.74 -46.44 1.23 Allowed 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.709 2.272 . . . . 0.0 112.363 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 217' ' ' GLY . 94.0 t -54.59 -55.09 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.187 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.06 -31.71 70.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.937 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 227' ' ' VAL . 22.1 tt0 -69.11 -36.28 77.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.58 83.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.22 -44.22 97.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -40.25 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 223' ' ' GLU . 38.9 t -55.38 -48.39 76.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.102 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 2.3 t -59.02 -50.11 75.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.831 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.09 -35.22 79.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.859 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 230' ' ' LEU . 0.3 OUTLIER -64.09 -34.24 77.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.908 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 67.4 m -73.56 -31.4 63.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.55 57.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.113 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.514 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.7 pp -64.9 -37.93 89.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.5 -34.97 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.36 -49.9 57.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -58.93 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.905 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 35.1 m -67.88 -39.81 83.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.145 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.63 -54.17 49.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -48.99 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.945 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.06 -33.47 69.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 179.943 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.88 0.372 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.02 -45.42 63.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.0 -33.58 65.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.48 -32.13 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.1 -48.56 78.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -45.49 31.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.118 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.55 -30.98 67.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.878 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.38 -33.49 56.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.441 HD11 HD21 ' A' ' 178' ' ' LEU . 8.6 mt -58.85 -35.78 73.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.794 0.331 . . . . 0.0 110.9 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -49.73 76.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -68.49 -48.0 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.34 -29.1 69.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.53 -51.6 14.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.912 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 19.1 p -65.93 -35.9 81.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.862 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -40.61 64.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.41 ' O ' HG23 ' B' ' 93' ' ' VAL . 12.2 m-20 -62.15 -48.58 79.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.3 -50.75 59.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -57.78 -42.79 84.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.88 -45.05 60.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.495 ' O ' HG23 ' B' ' 97' ' ' VAL . 4.0 t -59.59 -33.93 53.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.134 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -53.91 7.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.87 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.124 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.8 tptt -79.14 -35.89 41.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.898 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 93' ' ' VAL . 0.9 OUTLIER -50.69 -47.64 28.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.113 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.595 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -45.73 -68.07 0.33 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.576 0.703 . . . . 0.0 110.941 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.4 Cg_endo -69.74 -18.11 37.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.696 2.264 . . . . 0.0 112.35 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -66.18 -34.36 77.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.96 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -50.81 11.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.49 -35.52 74.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.93 -46.84 73.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -52.24 66.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.44 -47.93 74.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -62.52 -22.51 66.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -72.31 -48.42 42.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -24.98 59.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.888 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.17 -60.8 2.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.47 -34.59 77.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -69.19 -30.43 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.885 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -70.37 -53.67 15.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -66.68 -35.03 79.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.586 HD13 ' O ' ' B' ' 114' ' ' LEU . 3.1 tm? -76.06 -26.21 56.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.888 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.704 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.3 t80 -65.56 -54.94 20.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -73.12 -33.56 65.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.427 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 22.6 tt0 -70.45 -22.56 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.927 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -91.13 -45.61 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 115' ' ' TYR . 91.8 t -60.26 -32.77 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.155 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -58.04 -64.54 2.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.644 0.735 . . . . 0.0 110.892 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.1 Cg_endo -69.76 -50.29 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.685 2.257 . . . . 0.0 112.319 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -64.09 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.876 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.43 3.74 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.493 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -75.37 -45.39 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.822 0.344 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.72 -35.93 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 1.8 ttt -66.66 -54.04 27.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.877 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -39.3 93.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -68.83 -52.68 27.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 7.4 mmt-85 -63.63 -32.26 73.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.482 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.31 -42.89 92.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.082 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -62.18 -46.54 88.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.22 69.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.08 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -66.76 -50.67 61.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.482 HG12 ' O ' ' B' ' 152' ' ' ALA . 9.8 p -63.49 -40.02 87.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.168 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 157' ' ' ASP . . . . . 0.415 ' N ' HG13 ' B' ' 156' ' ' VAL . 21.0 t0 -52.84 -50.32 63.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.73 -48.96 67.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.145 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.39 -38.07 73.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 20.7 tpp85 -68.61 -45.15 72.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 34.8 m -55.8 -40.83 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.94 -34.07 29.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.836 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.33 -21.63 62.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -56.15 -62.39 4.85 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 0.0 111.092 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.1 Cg_endo -69.71 -41.56 4.23 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.724 2.282 . . . . 0.0 112.367 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 166' ' ' TYR . . . . . 0.416 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.4 t80 -56.51 -34.22 66.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.955 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.15 -51.45 69.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.69 -32.91 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -50.06 71.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.416 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.9 -37.96 77.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -51.66 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.937 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -39.34 81.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.867 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -41.59 77.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.15 75.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.87 71.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.77 -36.97 86.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.817 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 178' ' ' LEU . . . . . 0.589 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.3 tt -68.59 -51.37 43.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.897 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 179' ' ' GLU . . . . . 0.589 ' N ' HD23 ' B' ' 178' ' ' LEU . 10.0 pt-20 -65.45 -42.19 92.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.945 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.19 77.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.084 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -35.35 77.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -31.51 70.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.952 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -55.85 24.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.81 -25.82 63.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.54 -31.97 45.17 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.464 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -63.83 -49.9 64.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.495 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.86 -21.65 43.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.071 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -71.89 -29.11 64.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -49.9 75.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.39 -49.02 68.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.114 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.22 -34.2 76.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.867 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.2 -51.56 65.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.917 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -54.02 -48.8 70.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.835 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.82 69.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.123 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.73 -42.34 41.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.71 73.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 39.9 p -60.12 -46.82 88.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.084 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.87 -35.83 75.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.21 -54.32 45.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.821 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.07 -28.71 64.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.54 -51.27 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.81 30.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.117 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.84 -57.28 11.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.5 m -54.43 -35.98 63.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.97 -47.81 81.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.81 -27.78 44.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.46 -23.35 66.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.151 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.523 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.0 OUTLIER -64.47 -64.01 3.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.574 0.702 . . . . 0.0 110.923 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -26.89 27.36 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 0.0 112.331 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.68 -31.69 59.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.099 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 5.6 tt -71.13 -40.97 71.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.57 -51.12 66.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.903 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.94 -29.87 58.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.02 -45.69 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.91 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 215' ' ' ARG . . . . . 0.64 ' O ' HD13 ' B' ' 219' ' ' LEU . 8.6 mtp180 -73.01 -39.83 65.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.23 -25.07 65.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.547 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -80.69 -49.94 5.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.472 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -28.01 69.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.866 0.365 . . . . 0.0 110.896 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.64 HD13 ' O ' ' B' ' 215' ' ' ARG . 1.4 mp -50.45 -63.44 1.84 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.615 0.721 . . . . 0.0 110.921 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.82 -46.51 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.662 2.242 . . . . 0.0 112.338 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.547 HG23 ' O ' ' B' ' 217' ' ' GLY . 91.9 t -54.56 -55.08 17.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.124 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.08 -31.79 70.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.896 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.702 ' O ' HG23 ' B' ' 227' ' ' VAL . 22.0 tt0 -69.1 -36.17 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -47.65 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.24 -44.18 97.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.864 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -40.33 95.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.702 HG23 ' O ' ' B' ' 223' ' ' GLU . 38.6 t -55.39 -48.34 77.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.085 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 2.2 t -59.07 -50.06 75.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -35.33 79.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.541 HD13 ' O ' ' B' ' 230' ' ' LEU . 0.3 OUTLIER -64.1 -34.14 77.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 67.3 m -73.62 -31.41 63.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.57 56.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.077 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.7 pp -64.92 -37.95 89.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.41 -34.93 68.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.92 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.38 -50.01 56.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -58.87 -47.1 86.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.3 m -67.9 -39.86 83.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.61 -54.18 48.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -48.98 77.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 58.9 tp -58.08 -33.52 69.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.889 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.873 179.948 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.838 0.352 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.82 -54.91 39.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.58 -36.09 77.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -50.73 70.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.06 -31.44 61.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.662 HG23 HD23 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -59.01 -22.07 60.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.149 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.58 -34.18 17.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.84 -27.04 19.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.476 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.662 HD23 HG23 ' A' ' 79' ' ' THR . 2.0 pp -48.36 -35.65 12.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.789 0.328 . . . . 0.0 110.93 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -60.27 -50.21 74.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -45.08 96.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -49.06 73.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.13 -40.78 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -50.66 73.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.78 -46.27 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 22.2 t0 -55.6 -46.15 77.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -57.48 -50.24 73.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -48.58 69.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.21 -36.68 84.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 70.5 t -64.99 -32.03 56.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -73.92 -52.64 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.85 -33.66 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.103 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -77.89 -32.85 52.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.35 -43.59 86.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.178 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 mm-40 -43.59 -65.21 0.61 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.701 . . . . 0.0 110.866 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.74 -32.15 19.24 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.712 2.274 . . . . 0.0 112.306 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.404 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.2 t80 -58.58 -25.02 62.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.929 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.58 -51.07 25.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -33.0 74.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.872 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -47.54 68.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.825 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.91 -52.46 64.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -64.58 -47.27 79.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.914 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -60.31 -22.96 63.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -74.71 -46.87 34.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.942 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -29.79 70.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -68.64 -54.61 15.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.896 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -35.12 73.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.849 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -70.41 -30.48 67.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -71.43 -53.26 14.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.916 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.36 -35.03 79.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.8 tp -76.15 -26.12 55.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.706 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.1 t80 -66.48 -54.18 26.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.951 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -72.96 -34.05 66.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 43.1 tt0 -70.34 -23.79 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.93 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -89.04 -45.05 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.87 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 115' ' ' TYR . 99.5 t -61.33 -32.12 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.538 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.3 OUTLIER -56.22 -64.69 2.1 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.626 0.727 . . . . 0.0 110.845 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.5 Cg_endo -69.76 -52.02 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.693 2.262 . . . . 0.0 112.326 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -63.02 1.2 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.57 -32.38 2.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.458 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.31 -44.09 47.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.354 . . . . 0.0 110.927 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.56 -36.86 73.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -48.33 66.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.916 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -68.82 -37.75 79.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.2 -52.86 16.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -62.42 -41.37 98.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.64 -39.87 92.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.092 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -62.23 -53.12 59.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.12 61.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -60.58 -45.16 94.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.83 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.11 -53.72 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.37 -52.64 20.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.4 96.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.54 -41.89 86.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.941 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -65.54 -48.26 73.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 21.3 m -55.56 -42.46 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.129 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.88 -32.44 51.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.15 -19.63 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.8 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.68 -62.38 6.0 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.607 0.718 . . . . 0.0 111.121 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.8 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.1 Cg_endo -69.86 -47.12 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 0.0 112.327 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 166' ' ' TYR . . . . . 0.5 ' O ' HD13 ' A' ' 170' ' ' LEU . 19.7 m-30 -55.92 -27.44 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -51.35 64.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.846 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.32 -34.51 78.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -51.96 21.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.932 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 166' ' ' TYR . 8.8 mp -61.14 -49.45 77.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -61.22 -33.71 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -52.33 64.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.61 -43.1 69.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.97 -50.63 72.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.76 -32.81 74.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.25 -42.02 60.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.068 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -73.77 -32.09 63.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.69 -49.54 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.948 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.23 -35.59 71.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.02 -47.89 60.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.16 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.55 -43.32 93.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -32.43 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -51.03 68.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.92 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -69.08 -26.32 64.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.56 42.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.453 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.43 -31.9 36.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.462 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.47 -25.62 41.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -38.23 64.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -37.26 80.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.957 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.24 -48.78 40.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -47.99 81.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.29 -44.04 95.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.896 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.08 -47.44 71.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.861 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.49 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -76.07 -51.31 12.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.845 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.63 -45.66 78.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' THR . . . . . 0.507 HG21 HD13 ' B' ' 240' ' ' LEU . 95.3 m -59.59 -46.86 87.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.66 -38.65 91.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.59 -40.62 83.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.865 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -32.08 65.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.891 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 201' ' ' SER . . . . . 0.727 ' OG ' HG23 ' B' ' 237' ' ' THR . 0.5 OUTLIER -57.79 -50.99 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.854 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.29 -51.27 59.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.186 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.77 -50.23 68.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.82 -35.23 68.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.72 -47.81 84.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -31.75 56.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.34 63.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.085 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.5 OUTLIER -60.41 -63.12 4.66 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.601 0.715 . . . . 0.0 110.916 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.73 -27.65 26.37 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.68 2.254 . . . . 0.0 112.364 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.41 -31.82 58.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.29 -36.39 68.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.84 -50.91 65.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -73.68 -34.0 64.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.6 tt -61.46 -49.29 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.93 -36.1 83.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -57.03 -48.79 77.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.553 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.6 -29.52 74.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.438 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.19 -32.51 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.921 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.4 OUTLIER -49.42 -60.79 4.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.602 0.715 . . . . 0.0 110.947 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.82 -39.01 6.89 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.679 2.253 . . . . 0.0 112.333 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 217' ' ' GLY . 49.0 t -58.17 -55.33 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 -34.42 73.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.1 OUTLIER -66.58 -34.78 78.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -48.32 82.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.17 -42.5 79.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -63.08 -46.58 86.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 223' ' ' GLU . 40.1 t -56.89 -39.91 68.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.129 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 28.7 m -58.67 -50.26 74.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -61.25 -36.76 80.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.912 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.482 ' HA ' HD21 ' A' ' 233' ' ' LEU . 1.8 tp -63.71 -34.39 77.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -30.82 66.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.31 -51.37 53.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.111 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.0 OUTLIER -67.56 -44.79 77.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.867 -179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -35.81 79.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.13 -48.9 66.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -54.16 -40.72 67.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' OG ' ' B' ' 201' ' ' SER . 97.1 m -73.09 -40.23 65.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.54 -54.83 39.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -37.41 78.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 240' ' ' LEU . . . . . 0.474 HD13 HG21 ' B' ' 197' ' ' THR . 2.3 tp -57.68 -38.16 74.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 179.921 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.888 0.375 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.65 -54.92 39.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.75 -35.97 77.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.46 -50.69 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.887 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.12 -31.4 61.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' THR . . . . . 0.653 HG23 HD23 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -58.92 -22.07 59.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.145 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.7 -34.25 18.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.89 -27.09 20.0 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.653 HD23 HG23 ' B' ' 79' ' ' THR . 2.0 pp -48.46 -35.58 13.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 0.0 110.903 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 64.6 ttt-85 -60.3 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -45.04 96.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.89 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.08 73.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.27 -40.62 86.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.94 -50.62 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.95 -46.43 88.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.699 ' O ' HG23 ' B' ' 93' ' ' VAL . 22.1 t0 -55.38 -46.4 76.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 60.6 mt -57.46 -50.1 74.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -48.62 69.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.41 -36.58 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.901 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 89' ' ' ASP . 73.6 t -65.12 -32.07 56.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.16 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -74.38 -53.07 10.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.921 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.0 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -78.22 -33.05 50.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.13 -46.79 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.568 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.6 mm-40 -42.75 -66.52 0.42 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.663 0.744 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.568 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.78 -31.54 20.24 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.698 2.265 . . . . 0.0 112.305 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 100' ' ' TYR . . . . . 0.443 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 12.7 t80 -58.17 -24.19 58.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.52 -50.02 16.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.914 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -33.04 70.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.86 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -46.76 65.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -53.42 56.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -63.51 -47.72 80.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.937 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -61.06 -22.21 64.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -72.74 -48.08 41.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -63.4 -31.41 72.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.8 -55.82 20.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.1 -34.44 71.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.39 -32.75 70.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -53.45 18.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.4 -35.84 82.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.908 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -76.22 -25.96 55.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.877 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.696 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.4 t80 -65.68 -54.62 25.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -73.47 -33.59 64.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.867 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.421 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 44.0 tt0 -70.36 -23.05 62.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -90.83 -45.17 8.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.905 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.696 HG23 ' O ' ' B' ' 115' ' ' TYR . 87.6 t -60.8 -32.46 52.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.532 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.2 OUTLIER -58.15 -64.47 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.648 0.737 . . . . 0.0 110.864 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.532 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 54.2 Cg_endo -69.75 -50.41 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.712 2.275 . . . . 0.0 112.362 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -64.74 0.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.65 -31.96 2.75 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.496 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.1 -46.06 30.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.877 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.15 -41.0 77.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -52.21 58.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -64.43 -37.36 87.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.847 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.55 -51.81 46.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -64.59 -35.19 80.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -63.88 -45.63 88.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.065 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -60.04 -52.53 64.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -55.5 -54.54 42.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -61.52 -40.47 94.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 152' ' ' ALA . 2.6 t -60.03 -52.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -51.26 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.26 -45.61 93.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.073 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -40.21 81.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.937 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -66.15 -47.83 72.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 21.4 m -56.14 -42.64 77.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.132 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.37 -32.84 55.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.48 -19.22 62.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.02 -62.08 6.61 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.535 0.683 . . . . 0.0 111.043 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.5 Cg_endo -69.81 -46.52 1.18 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.669 2.246 . . . . 0.0 112.312 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 166' ' ' TYR . . . . . 0.506 ' O ' HD13 ' B' ' 170' ' ' LEU . 19.6 m-30 -56.68 -27.79 59.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.1 66.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.815 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -52.03 20.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.506 HD13 ' O ' ' B' ' 166' ' ' TYR . 8.9 mp -61.04 -49.17 78.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -61.46 -33.72 74.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.874 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.66 -52.16 65.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.892 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.16 -43.57 70.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.4 tp -60.82 -50.46 73.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.9 -32.87 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.97 60.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.101 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -73.84 -31.95 63.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.867 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.48 -48.74 66.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.11 -38.88 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -67.03 -46.96 72.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -60.85 -42.18 97.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.926 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -33.07 67.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -50.54 69.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -69.09 -26.39 64.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.43 -34.55 42.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.9 36.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.35 -25.76 42.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.809 0.338 . . . . 0.0 111.11 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -38.31 64.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -37.27 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.16 -48.79 40.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -47.74 82.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.49 -43.96 96.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.947 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.13 -47.51 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.841 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.15 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -76.01 -51.25 12.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.73 -45.7 77.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.071 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 197' ' ' THR . . . . . 0.474 HG21 HD13 ' A' ' 240' ' ' LEU . 94.9 m -59.58 -46.79 87.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.132 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -63.75 -38.6 91.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.848 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -58.62 -40.66 83.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.94 -32.0 64.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 201' ' ' SER . . . . . 0.706 ' OG ' HG23 ' A' ' 237' ' ' THR . 0.5 OUTLIER -57.78 -50.97 71.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.876 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.34 -51.24 59.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.184 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.82 -50.2 69.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.89 -35.26 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.65 -47.84 84.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -31.86 56.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.24 63.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.12 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.5 OUTLIER -60.55 -63.18 4.6 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 0.0 110.892 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -27.74 26.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.676 2.251 . . . . 0.0 112.365 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.37 -31.77 58.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.088 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.21 -36.28 69.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.81 -50.86 65.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.53 -34.2 65.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.824 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.38 -49.36 77.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.78 -36.16 83.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.84 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -57.03 -48.82 77.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.916 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.54 -29.46 74.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.508 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.25 -32.56 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.331 . . . . 0.0 110.883 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.4 OUTLIER -49.38 -60.86 4.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.597 0.713 . . . . 0.0 110.927 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 54.1 Cg_endo -69.69 -39.08 7.09 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.717 2.278 . . . . 0.0 112.383 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 49.0 t -58.21 -55.31 23.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.136 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -34.38 73.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.1 OUTLIER -66.63 -34.74 78.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -48.34 82.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.866 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.13 -42.62 79.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.08 -46.53 86.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' B' ' 223' ' ' GLU . 39.8 t -56.88 -39.92 68.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.142 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 28.5 m -58.73 -50.21 74.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.874 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.26 -36.77 80.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.475 ' HA ' HD21 ' B' ' 233' ' ' LEU . 1.8 tp -63.72 -34.31 77.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.55 -30.78 66.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.28 53.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.073 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.475 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.0 OUTLIER -67.61 -44.75 77.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -35.73 79.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -67.2 -48.91 66.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.838 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -54.22 -40.7 67.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 237' ' ' THR . . . . . 0.727 HG23 ' OG ' ' A' ' 201' ' ' SER . 96.9 m -73.07 -40.24 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.153 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.61 -54.75 40.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.903 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.06 -37.35 78.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.507 HD13 HG21 ' A' ' 197' ' ' THR . 2.2 tp -57.58 -38.24 74.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.869 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.919 179.954 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.873 0.368 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -56.5 21.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.918 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.06 -34.9 72.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -56.59 -51.33 69.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -32.07 65.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.21 -24.75 67.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.158 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -50.91 -33.13 22.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.03 -26.84 9.24 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.508 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -47.4 -40.7 18.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.626 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.1 mtt-85 -59.44 -49.83 76.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.12 -47.39 85.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.75 -49.69 67.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -40.37 82.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -59.88 -50.78 72.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.7 -46.21 87.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.666 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.1 t0 -55.47 -47.66 75.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.83 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -48.1 80.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.55 -47.57 76.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -36.58 83.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.666 HG23 ' O ' ' A' ' 89' ' ' ASP . 72.9 t -66.58 -31.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.162 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -52.75 10.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.83 -33.71 75.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -77.35 -33.51 55.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -59.5 -42.15 87.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.103 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.536 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.1 OUTLIER -44.92 -64.73 0.78 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.611 0.72 . . . . 0.0 110.918 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.78 -31.52 20.25 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.679 2.253 . . . . 0.0 112.34 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.423 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 16.4 t80 -60.78 -24.88 66.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.937 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.23 -50.8 24.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.945 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -65.66 -34.24 77.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.858 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -47.32 77.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -52.26 66.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.84 -46.9 82.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.25 -22.58 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.902 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -71.46 -45.54 62.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.887 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -25.67 61.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.936 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -65.47 -59.53 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -67.83 -34.31 76.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.2 -31.46 68.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.916 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -68.41 -54.11 19.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.87 -34.74 78.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.929 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.74 -26.19 54.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.94 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.674 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -64.35 -54.57 30.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -33.28 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -71.34 -24.92 62.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -87.18 -47.07 9.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.674 HG23 ' O ' ' A' ' 115' ' ' TYR . 72.7 t -60.89 -31.27 49.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.158 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.537 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 3.7 mt-10 -54.74 -64.7 1.77 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.583 0.706 . . . . 0.0 110.838 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.7 Cg_endo -69.77 -54.96 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.41 -62.48 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.01 -31.52 4.32 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.83 -42.77 57.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.796 0.331 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.19 -35.26 66.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 16.6 mtp -67.1 -48.92 66.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -37.54 79.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.841 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -71.0 -52.05 21.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -63.28 -35.65 81.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.935 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.608 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.77 -41.25 96.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.063 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -62.76 -47.97 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.08 -32.57 67.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -69.67 -50.43 44.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' VAL . . . . . 0.608 HG12 ' O ' ' A' ' 152' ' ' ALA . 14.6 p -66.26 -41.2 88.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.443 ' N ' HG13 ' A' ' 156' ' ' VAL . 25.6 t70 -53.39 -52.86 57.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.37 -48.36 75.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.2 -38.55 73.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -44.08 78.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.61 -42.99 79.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -80.95 -29.77 35.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 34.8 tp -70.69 -18.2 62.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' ALA . . . . . 0.804 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.95 -63.11 4.63 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.572 0.701 . . . . 0.0 111.106 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.804 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.3 Cg_endo -69.71 -44.88 1.85 Allowed 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.722 2.281 . . . . 0.0 112.356 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 166' ' ' TYR . . . . . 0.57 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 15.3 t80 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.907 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.6 -49.18 72.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.17 -46.66 87.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.3 -52.33 54.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.57 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 17.8 tp -58.59 -47.69 83.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 8.7 mmp_? -56.56 -38.31 71.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.929 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.62 -49.14 77.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -61.03 -47.72 85.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.917 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.92 -46.01 89.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -36.22 65.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.22 -34.7 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -33.6 76.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 8.9 tt -73.61 -49.39 26.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -50.3 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.68 73.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.108 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.02 -35.83 79.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -65.25 -27.8 68.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.4 -56.6 15.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.58 -48.36 77.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -56.05 -32.28 59.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.493 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.46 71.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.25 -54.24 7.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 0.0 111.121 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -55.75 -28.62 56.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 11.4 tp -56.09 -47.32 78.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.56 58.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.08 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -60.32 -34.16 73.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.51 -47.25 79.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.91 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.51 -47.63 72.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.55 -30.71 71.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.12 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -49.67 20.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.34 87.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.116 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.02 -47.03 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.72 -39.49 91.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.85 -38.03 77.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -34.17 65.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.948 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 201' ' ' SER . . . . . 0.647 ' HB3' HG23 ' B' ' 237' ' ' THR . 8.4 m -57.15 -50.74 71.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.819 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.37 -51.43 60.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.143 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.53 -47.76 72.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.914 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 24.6 p -59.33 -33.71 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.801 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.57 -46.97 88.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.56 -32.26 58.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.6 -20.35 63.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' LYS . . . . . 0.498 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -59.85 -62.82 5.12 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.593 0.711 . . . . 0.0 110.929 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.77 -27.34 26.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.693 2.262 . . . . 0.0 112.352 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.62 -35.59 60.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.126 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.75 -34.87 74.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.954 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -51.05 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -71.25 -34.65 70.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.88 -50.34 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -36.35 83.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -56.81 -48.56 77.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.954 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 217' ' ' GLY . . . . . 0.575 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.64 -29.26 74.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.51 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.03 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 219' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.6 OUTLIER -48.77 -60.73 4.13 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.627 0.727 . . . . 0.0 110.938 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 220' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.9 Cg_endo -69.75 -38.56 7.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.68 2.253 . . . . 0.0 112.367 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.0 t -58.17 -54.22 35.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -35.0 74.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.91 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 223' ' ' GLU . . . . . 0.627 ' O ' HG13 ' A' ' 227' ' ' VAL . 2.2 mt-10 -63.49 -37.29 86.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.899 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 -45.81 92.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.5 -36.46 68.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.64 -51.78 56.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 227' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 223' ' ' GLU . 30.0 m -57.62 -35.97 52.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.106 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.7 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 230' ' ' LEU . . . . . 0.579 HD13 HD11 ' A' ' 233' ' ' LEU . 2.9 mm? -63.48 -33.71 76.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -31.45 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.79 -51.7 52.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 233' ' ' LEU . . . . . 0.579 HD11 HD13 ' A' ' 230' ' ' LEU . 0.9 OUTLIER -67.9 -46.08 72.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.935 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.47 -36.22 75.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.22 -48.78 72.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -54.04 -39.84 66.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.939 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 237' ' ' THR . . . . . 0.699 HG23 ' HB3' ' B' ' 201' ' ' SER . 78.5 m -65.58 -46.45 79.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -55.07 37.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.867 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -44.85 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.78 -35.03 68.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.907 179.991 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -56.84 16.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.15 -34.96 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -56.65 -51.32 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -32.21 66.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -62.02 -24.86 67.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.12 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -51.06 -33.33 25.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.817 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.15 -26.93 9.71 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.437 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.62 HD23 ' N ' ' B' ' 83' ' ' ARG . 0.0 OUTLIER -47.38 -40.54 17.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.911 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ARG . . . . . 0.62 ' N ' HD23 ' B' ' 82' ' ' LEU . 5.1 mtt-85 -59.58 -49.77 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.26 -47.26 86.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.81 -49.7 67.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -40.05 81.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.878 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 51.4 m -60.08 -50.59 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.83 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.89 -46.28 88.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' ASP . . . . . 0.681 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.0 t0 -55.29 -47.92 74.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.895 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.55 -47.58 81.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.64 -47.45 76.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 -36.65 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.2 t -66.54 -31.23 52.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -53.02 9.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.43 -34.74 75.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -77.86 -33.96 51.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.02 -45.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.149 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.559 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.2 OUTLIER -44.08 -66.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.592 0.71 . . . . 0.0 110.952 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.559 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.81 -30.48 21.99 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.668 2.245 . . . . 0.0 112.313 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.4 t80 -60.89 -24.07 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -76.33 -50.6 13.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -60.99 -34.66 75.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -47.22 72.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -52.4 65.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.96 -47.59 79.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.06 -22.11 66.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 23.2 tptt -72.34 -46.49 55.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.856 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -26.41 63.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -65.98 -59.98 3.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.83 -34.56 78.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.34 -30.42 67.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -68.81 -54.13 17.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -66.65 -34.45 77.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.71 -26.1 54.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' TYR . . . . . 0.655 ' O ' HG23 ' B' ' 119' ' ' VAL . 6.2 t80 -65.85 -54.2 29.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 -33.35 65.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.833 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.408 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 56.6 tt0 -71.57 -24.12 61.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -88.47 -48.68 7.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.906 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' B' ' 115' ' ' TYR . 70.5 t -59.88 -31.54 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.088 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.7 mt-10 -55.59 -64.64 2.01 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.628 0.728 . . . . 0.0 110.88 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.7 Cg_endo -69.81 -52.73 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.71 2.274 . . . . 0.0 112.304 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.47 -63.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.74 -31.25 2.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -77.59 -45.78 24.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 0.0 110.893 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -68.7 -46.64 68.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.94 -51.82 65.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -60.52 -42.14 95.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -66.46 -51.4 57.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -60.86 -32.08 71.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.666 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -64.76 -47.83 76.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -58.81 -45.82 89.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.868 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.3 -33.52 67.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.09 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -69.0 -50.36 49.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' VAL . . . . . 0.666 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.6 p -65.17 -41.13 90.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 157' ' ' ASP . . . . . 0.408 ' N ' HG13 ' B' ' 156' ' ' VAL . 25.7 t70 -53.26 -52.68 58.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -48.73 73.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.076 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.16 -37.92 72.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -44.24 77.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.849 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.71 -42.41 79.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -81.43 -29.77 33.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 35.1 tp -70.86 -18.29 62.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.949 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -59.69 -62.96 4.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.589 0.709 . . . . 0.0 111.123 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.79 -44.0 2.31 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.703 2.269 . . . . 0.0 112.35 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 166' ' ' TYR . . . . . 0.582 ' CE2' HD22 ' B' ' 170' ' ' LEU . 15.8 t80 -58.41 -27.76 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 1.1 m -64.19 -48.74 74.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -62.1 -47.28 85.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.872 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.09 -52.26 56.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 170' ' ' LEU . . . . . 0.582 HD22 ' CE2' ' B' ' 166' ' ' TYR . 17.0 tp -58.47 -48.32 81.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 8.8 mmp_? -56.5 -37.33 70.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.45 -45.34 91.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.89 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -63.73 -47.58 80.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.842 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.28 -43.58 94.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.22 -36.99 69.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.94 -34.62 64.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.135 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -33.57 76.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 9.0 tt -73.49 -48.98 29.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.939 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.59 56.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.86 -49.45 73.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.64 -36.11 81.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.2 -27.73 68.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.922 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.48 -56.29 18.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.66 -46.84 83.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.906 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -57.43 -32.45 64.36 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.7 71.55 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.537 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.14 -54.11 7.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -55.77 -28.57 56.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.97 -47.77 77.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.911 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.66 -48.56 59.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.25 -34.09 73.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.934 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -64.48 -47.28 79.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.923 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.5 -47.85 72.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.86 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.33 -30.71 71.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.064 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -49.76 20.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.07 -39.19 86.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.0 -46.99 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.124 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.99 -39.25 90.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.93 -38.04 78.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.21 -34.22 65.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.946 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 201' ' ' SER . . . . . 0.699 ' HB3' HG23 ' A' ' 237' ' ' THR . 8.4 m -57.1 -50.67 72.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.44 -51.35 60.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.118 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -47.86 72.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.969 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 24.3 p -59.35 -33.53 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.58 -47.01 88.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.915 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -32.41 58.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.49 -20.25 63.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.51 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -60.0 -62.92 4.92 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.589 0.709 . . . . 0.0 110.888 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 209' ' ' PRO . . . . . 0.51 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.2 Cg_endo -69.77 -27.13 26.79 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.717 2.278 . . . . 0.0 112.347 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.81 -35.65 59.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.121 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 18.4 mt -69.66 -34.7 74.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.941 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.47 -50.94 64.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -71.21 -34.79 71.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.72 -50.53 73.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -36.31 83.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -56.76 -48.6 77.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.59 -29.24 74.44 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.526 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 7.9 tp -66.08 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 219' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.6 OUTLIER -48.7 -60.77 4.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 220' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.78 -38.58 7.56 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.677 2.251 . . . . 0.0 112.339 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 47.7 t -58.09 -54.28 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -35.12 74.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 223' ' ' GLU . . . . . 0.628 ' O ' HG13 ' B' ' 227' ' ' VAL . 2.2 mt-10 -63.35 -37.17 86.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.921 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 224' ' ' SER . . . . . 0.41 ' O ' HG22 ' B' ' 227' ' ' VAL . 1.5 m -60.51 -45.81 92.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.45 -36.47 68.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.61 -51.76 57.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 227' ' ' VAL . . . . . 0.628 HG13 ' O ' ' B' ' 223' ' ' GLU . 30.9 m -57.6 -35.97 52.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.151 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -51.38 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.72 -38.12 89.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.932 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 230' ' ' LEU . . . . . 0.587 HD13 HD11 ' B' ' 233' ' ' LEU . 2.9 mm? -63.53 -33.68 76.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -31.37 67.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.81 -51.65 53.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 233' ' ' LEU . . . . . 0.587 HD11 HD13 ' B' ' 230' ' ' LEU . 0.9 OUTLIER -67.97 -46.09 72.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.4 -36.36 75.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.12 -48.76 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -53.98 -39.88 66.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 237' ' ' THR . . . . . 0.647 HG23 ' HB3' ' A' ' 201' ' ' SER . 78.3 m -65.6 -46.41 79.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.142 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -55.08 36.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.865 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -44.83 80.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.895 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.74 -35.03 68.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 179.937 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.962 0.41 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.6 p -127.44 44.39 2.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.153 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.08 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -56.91 -43.13 81.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -72.44 -42.95 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -43.31 98.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -43.69 73.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -57.52 -46.94 83.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.659 ' HB2' HG23 ' A' ' 242' ' ' THR . 0.4 OUTLIER -77.75 -27.86 50.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.581 HD22 ' O ' ' A' ' 64' ' ' LEU . 1.1 tm? -54.53 -47.41 73.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.702 ' O ' HG22 ' A' ' 68' ' ' THR . . . 96.73 74.65 1.21 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.52 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -16.02 37.23 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.614 2.209 . . . . 0.0 112.348 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -55.25 -36.18 39.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.159 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.702 HG22 ' O ' ' A' ' 65' ' ' GLY . 8.8 t -58.25 -39.54 79.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.146 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -59.8 -51.25 70.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -66.85 -27.32 67.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.65 -61.68 2.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 21.4 p-90 -69.7 -32.61 71.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.937 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -67.0 -53.06 35.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.816 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -62.97 -43.96 97.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.919 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -57.5 11.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -58.03 -35.21 70.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.922 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -58.62 -52.07 67.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.94 -32.83 63.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.887 HG22 HD23 ' A' ' 82' ' ' LEU . 95.0 m -62.14 -25.96 68.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.168 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.76 -34.38 27.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.91 -27.76 14.61 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.441 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.887 HD23 HG22 ' A' ' 79' ' ' THR . 2.3 pp -48.62 -37.31 17.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.831 0.348 . . . . 0.0 110.921 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -59.65 -44.71 93.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.93 -49.61 73.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 6.4 mtp -58.16 -41.56 84.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.75 -50.61 73.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.58 -44.34 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.71 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER -56.5 -47.41 79.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.45 -49.67 75.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -54.34 -47.8 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.06 -34.92 79.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.94 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 89' ' ' ASP . 69.3 t -66.41 -32.3 57.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.14 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -74.93 -52.91 10.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.54 -33.65 75.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -77.53 -33.42 54.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -58.67 -43.07 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.136 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 5.6 mm-40 -44.38 -65.05 0.66 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.586 0.708 . . . . 0.0 110.908 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.4 Cg_endo -69.77 -32.27 18.85 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.672 2.248 . . . . 0.0 112.332 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 14.7 t80 -58.94 -25.26 63.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.9 mt -72.5 -50.64 24.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.59 -34.17 77.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -47.74 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.69 -52.22 65.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.74 -45.59 85.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -63.2 -22.61 66.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -73.25 -47.15 45.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -28.41 68.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -66.27 -56.46 11.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -70.28 -34.63 73.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.44 -32.53 71.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -69.2 -54.2 16.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -35.03 79.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.869 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.64 -26.25 54.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.76 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.0 t80 -63.33 -55.35 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -73.61 -36.02 65.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.851 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 72.6 tp60 -67.93 -22.56 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -89.07 -36.23 15.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 115' ' ' TYR . 85.5 t -64.86 -32.55 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.9 tt0 -59.56 -61.83 7.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.651 0.739 . . . . 0.0 110.859 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.6 Cg_endo -69.7 -52.32 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.677 2.251 . . . . 0.0 112.395 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 28.4 tp -69.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.89 -32.42 2.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.67 -44.66 32.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.814 0.34 . . . . 0.0 110.916 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.71 -42.63 81.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 35.4 mmt -66.82 -47.47 71.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.41 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.3 tpp85 -64.53 -42.94 95.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.8 -52.77 22.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -59.99 -34.9 73.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.844 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.34 -41.67 96.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.099 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -63.27 -48.27 78.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.03 71.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.101 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -69.31 -50.69 44.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.1 p -66.41 -41.58 89.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.463 ' N ' HG13 ' A' ' 156' ' ' VAL . 16.9 t70 -52.85 -52.26 57.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.93 75.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -39.27 74.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.947 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -45.12 75.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.908 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 22.6 m -55.88 -41.83 75.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.69 -31.5 32.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.13 -22.76 62.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.823 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.63 -62.56 3.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.577 0.703 . . . . 0.0 111.142 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.823 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.5 Cg_endo -69.83 -44.17 2.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -59.13 -31.37 68.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.938 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.8 t -56.71 -52.12 66.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.875 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.59 -47.57 80.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.871 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.8 -51.28 69.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.511 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.0 tm? -58.95 -44.71 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.21 -35.57 67.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -50.04 60.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.54 -40.11 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.6 tp -70.0 -49.82 47.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' ALA . . . . . 0.54 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.92 -34.31 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.15 -34.22 56.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.125 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -62.11 -49.05 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 175' ' ' ALA . 1.5 pp -66.99 -49.31 65.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.523 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.9 OUTLIER -59.39 -49.59 77.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.84 -46.8 78.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.86 -39.67 74.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -67.55 -28.17 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.868 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.75 -56.1 20.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.848 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.84 -27.53 65.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.16 -31.25 65.24 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.3 -48.7 66.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.48 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.25 -23.1 38.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.766 0.317 . . . . 0.0 111.054 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.81 -30.53 62.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.816 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -43.62 98.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.8 -48.82 43.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.097 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.94 -50.52 73.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -56.12 -46.7 79.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.919 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.19 -50.73 61.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.844 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.36 -31.01 68.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.123 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.41 -49.09 17.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.48 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.0 m -66.58 -48.36 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.147 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 26.3 pt-20 -70.86 -36.1 72.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -58.88 -47.64 84.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 mp -72.29 -29.8 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 58.0 m -56.91 -51.2 70.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 37.0 p -69.39 -50.35 46.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.151 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.41 -55.57 27.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 61.4 m -54.43 -35.88 63.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.875 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.85 -46.99 86.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -78.35 -27.84 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.04 -21.65 63.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.131 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.48 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -62.35 -60.71 9.26 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.561 0.696 . . . . 0.0 110.871 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 54.3 Cg_endo -69.72 -28.34 25.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.685 2.257 . . . . 0.0 112.366 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.78 -31.59 57.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.15 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.8 -38.39 73.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -54.19 -50.57 66.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.03 -31.18 58.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.849 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.59 -52.11 66.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -35.57 78.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.848 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -57.2 -48.91 77.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.866 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.82 -29.79 72.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.481 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.36 -32.4 73.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.8 OUTLIER -52.48 -61.65 4.31 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.595 0.712 . . . . 0.0 110.896 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.78 -43.79 2.44 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.661 2.241 . . . . 0.0 112.364 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 217' ' ' GLY . 57.0 t -57.2 -55.08 22.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.14 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.73 -33.19 71.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.621 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -68.43 -34.98 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.92 83.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.858 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -65.6 -42.57 91.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.34 -44.84 90.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 223' ' ' GLU . 42.9 t -55.54 -42.69 69.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.102 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -49.82 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -65.08 -38.5 90.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 233' ' ' LEU . 2.3 mm? -64.96 -34.05 77.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.21 -30.98 65.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.88 56.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.069 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -67.18 -36.54 81.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.945 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.16 -35.97 69.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.78 -49.14 32.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.87 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.31 -37.27 80.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.9 m -71.04 -46.37 62.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.161 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -56.46 -53.93 51.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.87 -48.79 78.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.9 -34.53 69.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -72.97 -26.46 61.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 242' ' ' THR . . . . . 0.659 HG23 ' HB2' ' A' ' 63' ' ' GLN . 2.0 m 73.92 -68.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.949 0.404 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 29.3 p -128.01 44.43 2.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.159 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -128.24 -67.42 0.81 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.7 m -56.99 -43.1 81.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.859 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -72.45 -43.0 64.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.97 -43.24 99.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.91 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.16 -43.81 73.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.847 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -57.42 -47.0 82.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.727 ' HB2' HG23 ' B' ' 242' ' ' THR . 0.4 OUTLIER -77.71 -27.91 50.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.586 ' O ' HD22 ' B' ' 64' ' ' LEU . 1.1 tm? -54.59 -47.32 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' GLY . . . . . 0.697 ' O ' HG22 ' B' ' 68' ' ' THR . . . 96.69 74.58 1.21 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.505 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -16.2 37.68 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.668 2.245 . . . . 0.0 112.361 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.14 -36.07 37.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.173 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' THR . . . . . 0.697 HG22 ' O ' ' B' ' 65' ' ' GLY . 8.7 t -58.34 -39.57 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.74 -51.31 70.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -66.86 -27.36 67.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.53 -61.75 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 21.8 p-90 -69.7 -32.63 71.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.897 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -66.94 -53.02 35.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.03 -44.05 96.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.925 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.45 -57.47 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.946 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.12 -35.3 71.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -58.47 -52.2 66.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -32.81 63.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' THR . . . . . 0.861 HG22 HD23 ' B' ' 82' ' ' LEU . 95.3 m -62.09 -25.92 67.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.168 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -34.39 27.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.9 -27.71 14.43 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.488 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.861 HD23 HG22 ' B' ' 79' ' ' THR . 2.4 pp -48.7 -37.51 18.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.778 0.323 . . . . 0.0 110.913 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.64 -49.78 76.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -59.68 -44.87 93.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.92 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.73 -49.71 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 6.3 mtp -58.26 -41.42 84.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.79 -50.58 73.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.89 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.64 -44.43 90.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.2 OUTLIER -56.28 -47.82 77.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.37 -49.39 76.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.35 -47.4 72.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.929 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.68 -34.95 79.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.9 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' B' ' 89' ' ' ASP . 76.1 t -66.48 -32.15 56.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.159 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -75.5 -53.29 8.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.91 75.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.104 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -77.76 -33.69 52.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.881 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -55.43 -46.43 78.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.561 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 5.2 mm-40 -43.48 -66.24 0.47 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.576 0.703 . . . . 0.0 110.913 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.561 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.73 -31.46 20.62 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 0.0 112.349 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 100' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.5 t80 -58.66 -24.7 61.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.88 -50.14 15.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.929 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.83 -34.38 73.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.69 -47.56 69.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.09 -52.61 63.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.31 -46.16 84.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -62.2 -22.56 66.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.872 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -72.95 -47.41 45.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.89 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.86 -30.82 71.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -63.98 -56.4 15.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.14 -34.29 72.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -70.57 -31.68 68.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.904 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' MET . . . . . 0.41 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 1.2 tmt? -69.95 -54.48 13.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.15 -35.52 81.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.51 -25.94 54.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.953 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.9 t80 -63.13 -55.57 24.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.932 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -74.43 -33.94 63.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.443 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 72.6 tp60 -69.58 -21.93 63.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -91.24 -36.31 13.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 97.2 t -65.68 -32.62 58.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.475 ' N ' ' HD2' ' B' ' 143' ' ' PRO . 2.8 tt0 -60.67 -61.45 7.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.672 0.749 . . . . 0.0 110.89 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.75 -51.54 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.342 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 23.3 tp -70.84 -64.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.4 -32.21 1.76 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.462 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -77.74 -47.32 19.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 110.882 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 -45.68 78.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.5 mmt -64.91 -51.94 59.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.836 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.7 tpp85 -60.29 -43.59 96.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -66.75 -51.69 52.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.848 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.49 -31.91 70.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.655 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.48 -47.27 76.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.088 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 12.8 tpt85 -59.16 -45.3 91.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.65 -34.19 67.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.133 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -68.87 -50.05 53.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.83 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.655 HG12 ' O ' ' B' ' 152' ' ' ALA . 8.7 p -65.23 -41.36 91.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 157' ' ' ASP . . . . . 0.426 ' N ' HG13 ' B' ' 156' ' ' VAL . 17.1 t70 -53.06 -51.95 60.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.05 -48.55 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -37.93 73.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -44.96 74.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 22.8 m -56.15 -41.86 76.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.164 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.56 -31.14 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.87 -22.64 62.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.837 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.84 -62.52 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.577 0.703 . . . . 0.0 111.121 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.837 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.76 -42.43 3.41 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.71 2.273 . . . . 0.0 112.35 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -60.74 -31.16 70.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.943 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.7 t -57.4 -51.85 67.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.829 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.23 -47.64 81.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.27 -51.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.877 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.512 ' O ' HD22 ' B' ' 170' ' ' LEU . 2.0 tm? -58.86 -44.45 91.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.36 -36.07 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -49.44 64.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.25 -41.47 96.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 25.1 tp -69.27 -48.94 60.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.939 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' ALA . . . . . 0.534 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.1 -34.34 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.102 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.41 57.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.124 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -61.98 -48.89 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' B' ' 175' ' ' ALA . 1.6 pp -67.32 -48.96 66.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 179' ' ' GLU . . . . . 0.53 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.9 OUTLIER -59.3 -50.32 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.61 77.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.063 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -57.13 -39.39 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -68.3 -28.23 67.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -55.76 23.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.854 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.92 -27.38 65.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.24 -31.41 65.8 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.18 -48.81 66.09 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.473 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.15 -23.18 38.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.318 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.72 -30.53 62.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -43.77 98.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.84 -48.68 44.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.117 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.96 -50.41 73.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -56.38 -46.69 79.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.17 -50.22 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.85 -30.97 69.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.3 -48.95 18.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.26 -34.12 76.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.1 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.4 m -65.87 -48.66 70.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -70.91 -36.15 72.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.82 -47.56 84.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.37 -29.75 64.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.926 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 57.7 m -56.98 -51.09 70.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.848 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 36.6 p -69.37 -50.27 47.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.158 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.49 -55.58 27.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.879 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 61.3 m -54.51 -35.85 63.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.835 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.87 -46.88 86.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.888 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -78.47 -27.83 46.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.11 -21.74 63.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.485 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -62.27 -60.75 9.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.554 0.692 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.8 -28.25 25.28 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.711 2.274 . . . . 0.0 112.333 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.95 -31.55 56.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.126 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.62 -38.5 73.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.926 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -54.12 -50.43 66.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -75.88 -31.11 59.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.72 -52.22 66.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -35.46 78.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -57.21 -48.87 77.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.491 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.89 -29.82 72.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.493 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.31 -32.47 73.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.8 OUTLIER -52.45 -61.67 4.27 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.616 0.722 . . . . 0.0 110.923 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 54.0 Cg_endo -69.73 -43.83 2.45 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 0.0 112.398 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.491 HG23 ' O ' ' B' ' 217' ' ' GLY . 56.6 t -57.23 -55.11 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.171 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -33.32 71.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.632 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.4 mt-10 -68.45 -34.92 76.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -47.96 83.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.856 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -65.64 -42.4 91.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.42 -44.9 89.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.867 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.632 HG23 ' O ' ' B' ' 223' ' ' GLU . 43.0 t -55.53 -42.67 69.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.14 -49.82 76.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -65.1 -38.53 91.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.508 HD13 HD11 ' B' ' 233' ' ' LEU . 2.3 mm? -64.87 -34.09 77.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.907 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.26 -30.91 65.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.55 -50.75 57.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.508 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -67.31 -36.42 81.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.2 -36.06 69.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.73 -49.13 33.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.877 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -60.35 -37.24 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.925 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 98.1 m -70.99 -46.44 62.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.169 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 7.1 ttmt -56.45 -53.9 51.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.84 -48.81 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 29.6 mt -57.92 -34.55 69.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.925 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -72.84 -26.51 61.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 242' ' ' THR . . . . . 0.727 HG23 ' HB2' ' B' ' 63' ' ' GLN . 2.0 m 73.88 -67.95 0.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.126 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.7 m . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.958 0.408 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -135.34 -71.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.109 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 56.24 44.83 24.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.8 t -61.59 -41.52 97.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.862 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -35.9 74.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.871 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -42.48 96.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.956 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.98 -46.71 61.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.35 -38.99 92.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -78.04 -28.32 48.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.582 HD22 ' O ' ' A' ' 64' ' ' LEU . 1.2 tm? -52.55 -48.79 65.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.938 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.462 ' N ' HD13 ' A' ' 64' ' ' LEU . . . 94.1 73.64 1.22 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.5 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -25.54 28.8 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.685 2.257 . . . . 0.0 112.379 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.421 HG23 ' N ' ' A' ' 68' ' ' THR . 16.5 m -56.37 -44.08 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.137 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.421 ' N ' HG23 ' A' ' 67' ' ' VAL . 61.3 p -70.64 -57.33 4.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -41.37 64.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.867 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.48 -32.32 66.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -53.53 56.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -73.08 -44.48 60.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.901 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -56.87 -52.28 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.72 -41.39 87.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.819 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' A' ' 79' ' ' THR . 35.1 tp -59.85 -55.26 36.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.948 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.61 -33.81 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.885 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.18 -49.4 74.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.54 -34.01 76.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 75' ' ' LEU . 28.8 p -73.11 -23.45 60.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -50.96 -31.96 19.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.32 -30.7 40.95 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 79' ' ' THR . 2.6 pp -51.67 -36.88 48.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.35 -49.67 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.876 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.23 -41.73 98.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.04 -48.08 81.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.3 mmt -62.5 -40.09 95.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -58.76 -50.24 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.869 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -60.56 -46.24 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 20.3 t70 -55.62 -47.59 76.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.888 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tp -58.15 -50.85 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.08 66.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.836 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -62.64 -37.96 88.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.893 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 96.2 t -65.34 -31.68 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.138 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -74.93 -53.93 8.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.895 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.57 -30.67 71.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.96 -36.11 42.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.34 -43.33 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.187 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.551 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.9 mm-40 -44.33 -65.23 0.64 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.61 0.719 . . . . 0.0 110.943 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.551 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.9 Cg_endo -69.8 -27.27 26.46 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -53.72 -57.29 11.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.628 HD23 ' HB3' ' B' ' 160' ' ' ARG . 1.7 mp -53.65 -29.13 36.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.929 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.82 -47.04 73.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.04 -42.83 93.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -50.74 72.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.883 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -47.5 85.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -26.2 68.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -45.79 67.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.868 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -23.17 61.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -66.21 -64.83 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -63.4 -34.78 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.892 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -70.51 -30.07 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.874 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.408 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 1.2 tmt? -65.65 -51.64 57.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.852 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -40.67 96.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -25.34 56.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.773 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.6 t80 -61.92 -54.97 34.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -71.18 -39.26 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.854 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -65.28 -25.67 67.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.35 -40.91 12.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.9 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 115' ' ' TYR . 59.0 t -57.61 -31.76 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.544 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.9 mt-10 -60.12 -65.09 2.31 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.587 0.708 . . . . 0.0 110.868 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.544 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 54.1 Cg_endo -69.73 -51.42 0.39 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.714 2.276 . . . . 0.0 112.374 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -63.61 1.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.907 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.18 -31.84 1.48 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.481 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -75.37 -43.58 49.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 0.0 110.857 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -71.83 -37.37 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -67.54 -47.74 69.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.834 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.403 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 9.3 tpp180 -66.31 -39.92 89.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.87 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -71.37 -51.34 24.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -62.46 -38.27 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.22 -42.47 99.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.79 -50.91 70.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.05 70.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.084 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.16 -50.6 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 10.7 p -67.34 -35.53 74.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.129 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -57.3 -51.25 70.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.01 56.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.087 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 22.2 tp -56.76 -42.57 79.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.587 ' HB3' HD23 ' B' ' 101' ' ' LEU . 0.6 OUTLIER -68.47 -38.88 81.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.88 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 61.8 m -56.95 -47.61 80.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.09 -34.9 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.87 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.3 tp -72.31 -15.08 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.815 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -62.3 -62.05 6.5 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.609 0.719 . . . . 0.0 111.15 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.815 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.73 -39.4 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.364 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -63.16 -34.22 77.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.95 -48.58 73.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -62.02 -49.39 76.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.46 -51.07 68.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 31.7 tp -60.62 -50.04 75.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.57 -34.01 76.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.833 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.86 -35.23 79.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -49.02 38.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.867 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -51.47 47.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.31 -43.02 74.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.109 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.95 -39.35 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.05 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -33.43 75.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.887 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.76 -50.17 26.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.39 -50.93 57.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.27 76.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.086 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 18.8 tp -63.79 -34.78 78.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -65.28 -33.54 76.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.82 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.53 -45.16 77.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -67.56 -26.28 66.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.12 -33.57 37.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.445 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.1 -32.3 35.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.502 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.25 -25.74 42.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 111.133 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.75 -35.25 65.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -37.18 86.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.907 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.33 38.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.063 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -49.08 77.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.47 -42.69 92.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.84 -50.16 66.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.96 -30.92 70.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.088 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.36 -49.73 18.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.66 -34.82 77.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.156 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.1 m -64.23 -47.67 78.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.14 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.87 -37.77 79.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -42.85 90.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -30.95 64.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 20.3 m -57.18 -51.02 70.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.865 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 4.8 p -67.74 -50.38 57.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.159 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.0 tp -55.06 -53.06 60.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 14.1 m -54.64 -36.17 64.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.814 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -46.27 88.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -28.85 48.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.896 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.08 62.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.489 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 4.4 tptt -61.07 -60.37 10.85 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.589 0.709 . . . . 0.0 110.893 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.71 -29.16 24.54 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.694 2.263 . . . . 0.0 112.41 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.54 -29.82 56.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.085 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tt -72.54 -38.66 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.91 -51.22 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.883 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.75 -31.25 61.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.4 HD23 ' N ' ' A' ' 215' ' ' ARG . 4.7 tt -62.91 -52.46 62.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.95 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 215' ' ' ARG . . . . . 0.4 ' N ' HD23 ' A' ' 214' ' ' LEU . 36.7 ttp180 -63.7 -37.76 88.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.874 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -56.67 -48.32 77.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.75 -29.25 74.42 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.457 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.88 -33.07 74.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.836 0.351 . . . . 0.0 110.883 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.1 mp -48.3 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.583 0.706 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.2 Cg_endo -69.78 -37.72 8.74 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.683 2.255 . . . . 0.0 112.324 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 217' ' ' GLY . 47.2 t -58.55 -54.87 27.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.172 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -34.98 74.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.6 OUTLIER -65.22 -34.62 78.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.15 -48.43 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.31 -43.18 70.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -62.49 -48.86 77.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.828 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 223' ' ' GLU . 24.9 t -56.74 -38.78 59.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.56 -50.1 75.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.865 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.78 -38.48 90.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.762 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -65.22 -34.76 79.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 10.8 m -70.14 -30.42 67.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.829 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.16 48.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.123 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.762 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -69.2 -38.99 78.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.65 -39.65 84.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -72.26 -48.62 41.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.7 -35.89 69.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 93.9 m -70.73 -47.33 60.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.109 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -53.79 52.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -61.73 -48.72 79.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.83 -35.09 70.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -69.01 -28.95 67.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.53 -68.18 0.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.182 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.972 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.943 0.402 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -135.5 -71.38 0.47 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.117 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 56.32 44.93 23.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.859 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 12.8 t -61.65 -41.59 97.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.825 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.21 -35.88 74.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -42.38 96.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.98 -46.76 61.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.865 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.3 -39.01 93.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -78.04 -28.37 48.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.591 ' O ' HD22 ' B' ' 64' ' ' LEU . 1.2 tm? -52.44 -48.92 65.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.942 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' GLY . . . . . 0.46 ' N ' HD13 ' B' ' 64' ' ' LEU . . . 94.19 73.6 1.21 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.485 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -25.38 28.4 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.628 2.219 . . . . 0.0 112.353 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' VAL . . . . . 0.428 HG23 ' N ' ' B' ' 68' ' ' THR . 16.5 m -56.36 -44.01 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.139 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' THR . . . . . 0.428 ' N ' HG23 ' B' ' 67' ' ' VAL . 60.6 p -70.78 -57.29 4.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.129 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.96 -41.27 64.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.933 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.47 -32.41 66.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.886 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -53.48 57.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.865 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -73.12 -44.43 60.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -56.91 -52.22 66.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.918 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -66.7 -41.38 88.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' B' ' 79' ' ' THR . 35.0 tp -59.86 -55.34 35.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.52 -33.82 76.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.876 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -49.51 73.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.46 -34.05 76.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.877 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' B' ' 75' ' ' LEU . 28.8 p -73.14 -23.4 60.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.03 -31.93 19.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.893 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.42 -30.7 41.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.476 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.504 HD23 ' O ' ' B' ' 79' ' ' THR . 2.5 pp -51.65 -36.79 47.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -58.49 -49.61 76.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.11 -42.01 98.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.923 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.74 -48.39 79.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.2 mmt -62.27 -40.0 94.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 44.4 m -58.63 -50.23 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.835 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -60.45 -46.52 89.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.709 ' O ' HG23 ' B' ' 93' ' ' VAL . 20.3 t70 -55.44 -47.97 75.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.891 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.86 -50.78 72.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.11 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.12 -36.66 84.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.925 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 89' ' ' ASP . 97.3 t -66.45 -31.76 55.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -75.21 -54.93 6.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.18 72.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.68 -36.57 43.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -54.22 -47.45 67.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.108 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.57 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.0 mm-40 -42.68 -66.76 0.39 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.562 0.696 . . . . 0.0 110.904 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.57 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.69 -24.32 30.12 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.703 2.268 . . . . 0.0 112.339 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -53.54 -54.98 29.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.941 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.587 HD23 ' HB3' ' A' ' 160' ' ' ARG . 0.3 OUTLIER -59.46 -28.36 66.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.87 -48.49 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.848 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.28 -43.94 84.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -51.54 67.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.877 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -47.52 85.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.25 -25.48 64.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.97 -48.93 41.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.918 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -25.63 67.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -68.02 -66.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.9 -35.51 76.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.858 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -70.96 -29.3 65.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.902 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' MET . . . . . 0.403 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 0.8 OUTLIER -65.49 -51.37 60.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.826 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -39.11 93.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -25.72 56.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.895 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.726 ' O ' HG23 ' B' ' 119' ' ' VAL . 17.6 t80 -64.23 -55.58 20.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.974 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -69.4 -38.61 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -66.6 -24.51 66.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -91.79 -42.56 10.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.726 HG23 ' O ' ' B' ' 115' ' ' TYR . 62.2 t -56.98 -31.47 36.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.527 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mt-10 -61.45 -64.85 2.61 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.649 0.738 . . . . 0.0 110.904 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.527 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.4 Cg_endo -69.74 -51.82 0.36 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -63.95 1.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.99 -31.0 1.11 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -77.2 -45.21 27.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -70.24 -43.84 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -64.9 -51.2 63.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.408 ' HG3' ' HG3' ' A' ' 112' ' ' MET . 10.3 tpp180 -62.09 -41.09 97.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.857 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -68.31 -50.92 50.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.815 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -62.26 -33.73 75.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.57 -49.68 72.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.09 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -56.66 -49.54 74.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.897 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.99 -32.93 72.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.106 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.5 -50.15 60.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.837 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.3 -35.55 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.13 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -57.6 -50.78 72.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.1 58.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.109 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 22.0 tp -57.37 -42.21 81.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 160' ' ' ARG . . . . . 0.628 ' HB3' HD23 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -67.64 -39.54 84.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 86.1 m -57.25 -46.88 82.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.48 -34.94 47.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 tp -72.4 -15.37 61.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.93 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.794 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -62.13 -61.96 6.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.582 0.706 . . . . 0.0 111.076 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.794 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.73 -38.7 7.5 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -63.86 -34.95 79.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.02 -48.37 76.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -62.2 -49.24 76.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.867 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.4 -51.16 68.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.912 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.61 -50.1 74.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.35 -33.9 76.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -35.33 80.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -48.82 41.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.38 48.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.888 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.56 -42.75 75.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.04 -39.11 63.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.142 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -34.15 77.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.892 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 178' ' ' LEU . 0.4 OUTLIER -72.52 -49.35 33.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -67.19 -50.48 60.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.71 80.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 19.1 tp -64.36 -34.51 78.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -66.62 -33.77 76.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -44.71 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.875 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -68.05 -26.09 65.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.09 -33.59 37.7 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.482 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.0 -32.38 34.58 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.459 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.68 42.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.339 . . . . 0.0 111.128 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.73 -35.69 65.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -37.35 86.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.85 -49.25 39.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.137 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -48.44 79.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.88 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.92 -42.83 94.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.88 -49.99 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.83 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.07 -30.91 70.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.53 -49.6 18.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.71 -35.03 78.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 63.5 m -64.16 -47.56 79.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.163 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.85 -37.88 79.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.847 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -42.74 90.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.849 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.0 -30.9 64.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 20.2 m -57.28 -50.95 71.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 4.9 p -67.68 -50.38 57.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.9 tp -55.09 -53.04 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 13.9 m -54.71 -36.12 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.828 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -46.23 88.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.859 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -28.78 48.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.15 62.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.494 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 4.5 tptt -61.12 -60.3 11.06 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.564 0.697 . . . . 0.0 110.876 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.7 Cg_endo -69.8 -29.17 24.09 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.663 2.242 . . . . 0.0 112.3 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -29.76 56.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.109 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.39 -38.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.84 -51.03 64.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.81 -31.27 61.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.413 HD23 ' N ' ' B' ' 215' ' ' ARG . 4.7 tt -62.93 -52.45 62.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.919 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 215' ' ' ARG . . . . . 0.413 ' N ' HD23 ' B' ' 214' ' ' LEU . 36.5 ttp180 -63.88 -37.6 88.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -56.64 -48.4 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.581 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.79 -29.3 74.49 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.482 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.74 -33.13 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.886 0.374 . . . . 0.0 110.956 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.1 mp -48.28 -60.79 3.87 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 0.0 110.916 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.8 Cg_endo -69.72 -37.72 8.88 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.675 2.25 . . . . 0.0 112.328 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.581 HG23 ' O ' ' B' ' 217' ' ' GLY . 46.3 t -58.65 -54.81 28.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.51 -35.12 75.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.465 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.6 OUTLIER -65.15 -34.61 78.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.844 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.18 -48.46 79.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.789 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.27 -43.21 70.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.1 tttm -62.49 -48.83 77.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 223' ' ' GLU . 24.8 t -56.69 -38.82 59.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.55 -50.13 74.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.82 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -38.48 90.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.907 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.765 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -65.23 -34.82 79.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.937 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 10.4 m -70.05 -30.41 67.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.45 -50.22 47.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.765 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -69.12 -39.03 79.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.908 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -67.62 -39.56 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.33 -48.62 40.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.66 -35.92 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 93.5 m -70.67 -47.35 60.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -53.76 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -61.82 -48.63 79.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 28.0 mt -57.86 -35.06 70.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.921 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -69.01 -29.04 67.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.63 -68.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.152 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.888 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.935 0.398 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -142.31 85.0 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -103.43 179.73 4.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.843 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -39.2 65.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.933 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -68.46 -43.66 76.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.889 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.447 ' O ' HD23 ' A' ' 64' ' ' LEU . 4.8 mt -69.66 -35.6 75.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.973 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 mtt180 -66.78 -50.51 62.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.853 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -37.76 83.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.91 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.62 -25.73 60.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.955 HD12 HG11 ' A' ' 67' ' ' VAL . 0.2 OUTLIER -53.53 -39.56 64.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.873 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' A' ' 67' ' ' VAL . . . 106.47 -161.86 13.96 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.453 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 33.05 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.674 2.249 . . . . 0.0 112.307 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.955 HG11 HD12 ' A' ' 64' ' ' LEU . 17.7 m -75.81 -30.28 21.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -43.52 -38.49 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -58.28 -50.02 75.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.925 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.29 -32.89 74.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -62.69 -54.92 31.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.59 -34.86 78.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.946 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.77 -54.13 17.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -65.02 -41.66 95.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.74 -55.13 36.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.31 -38.29 73.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.03 -51.66 67.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -30.72 61.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.959 HG22 HD23 ' A' ' 82' ' ' LEU . 91.4 m -59.25 -22.08 60.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.169 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.01 -34.52 13.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.88 -27.15 20.11 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.469 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.959 HD23 HG22 ' A' ' 79' ' ' THR . 2.0 pp -48.31 -35.65 12.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.801 0.334 . . . . 0.0 110.893 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -50.22 74.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.13 -43.81 98.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.41 -49.28 74.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.63 -41.58 86.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -58.62 -50.6 73.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.837 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.83 -45.08 90.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.16 -46.84 79.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.23 -50.39 73.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.78 -48.27 69.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.68 -35.57 81.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.886 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 89' ' ' ASP . 63.2 t -65.62 -32.29 57.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.162 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.39 -52.77 11.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.73 -33.27 73.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.088 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -78.03 -33.15 51.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.82 -42.68 86.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.178 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 mt-30 -44.6 -64.89 0.71 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.592 0.71 . . . . 0.0 110.918 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.8 -32.9 17.52 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.717 2.278 . . . . 0.0 112.317 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.413 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 15.7 t80 -59.11 -25.22 63.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.1 -50.88 20.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.8 -32.52 73.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.896 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -47.4 65.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.913 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -56.09 -52.41 64.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.23 -47.54 76.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -61.0 -22.75 64.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.919 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -74.32 -45.98 43.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -30.53 71.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -66.18 -55.88 14.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -69.65 -34.46 74.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.94 -31.73 68.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.03 -54.24 16.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.897 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.51 -35.13 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.62 -25.91 54.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.786 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -65.25 -54.62 26.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -41.31 65.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.403 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 39.3 tt0 -62.01 -25.81 67.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -84.81 -39.23 18.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 115' ' ' TYR . 84.9 t -59.45 -32.49 48.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.157 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.541 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 4.7 mt-10 -57.61 -64.78 2.28 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.645 0.736 . . . . 0.0 110.921 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.8 Cg_endo -69.74 -51.14 0.4 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.699 2.266 . . . . 0.0 112.356 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.2 tp -67.27 -64.3 0.88 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.23 -32.67 3.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.451 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -74.36 -43.84 54.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -70.89 -35.49 72.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -49.96 64.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -68.12 -37.13 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.879 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -71.24 -53.57 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -61.44 -37.05 82.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.848 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.577 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -63.77 -40.22 96.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.113 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.401 ' HG3' ' CH2' ' B' ' 108' ' ' TRP . 0.0 OUTLIER -63.02 -49.65 73.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.99 -32.39 69.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -69.82 -50.87 38.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.4 p -67.09 -41.55 87.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.131 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.46 ' N ' HG13 ' A' ' 156' ' ' VAL . 6.3 t70 -53.33 -52.63 58.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.31 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.109 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 163' ' ' LEU . 2.1 mp -56.77 -45.3 82.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -63.31 -44.09 95.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.882 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 32.2 m -56.09 -40.78 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.41 -31.23 33.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 159' ' ' LEU . 1.8 mm? -69.34 -22.27 63.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.899 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.812 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.97 -62.7 3.81 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.549 0.69 . . . . 0.0 111.114 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.812 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.83 -45.85 1.4 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.67 2.247 . . . . 0.0 112.347 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.55 -29.13 64.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -52.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.836 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.86 -33.18 75.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.839 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.71 -51.91 30.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.846 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.29 -49.34 64.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.88 -35.95 69.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.87 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.86 -41.9 82.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.843 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -72.31 -40.52 67.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.865 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -50.56 38.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.928 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.62 -40.96 80.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.092 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.1 -41.83 61.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.099 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -65.72 -34.15 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.558 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -69.54 -50.07 48.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.558 ' N ' HD23 ' A' ' 178' ' ' LEU . 77.1 mt-10 -69.4 -35.57 75.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.13 -49.17 53.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.125 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.9 -43.15 81.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -70.28 -30.86 67.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.881 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -55.48 31.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.85 -26.79 68.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.74 -34.47 44.39 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.69 -33.3 41.61 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.498 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.39 42.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.32 . . . . 0.0 111.092 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -73.1 -32.67 65.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.427 HD22 ' CD2' ' B' ' 72' ' ' TRP . 0.1 OUTLIER -62.36 -39.49 93.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.958 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.38 35.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.08 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -49.56 75.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -57.99 -44.24 87.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -53.64 -49.37 68.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.878 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.41 -31.3 70.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.096 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -49.6 16.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.57 -34.7 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.114 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' THR . . . . . 0.602 HG21 HD22 ' B' ' 240' ' ' LEU . 86.1 m -65.76 -47.57 74.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.148 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.44 -36.16 76.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.91 -46.44 87.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.837 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -30.13 64.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.03 -51.11 70.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.813 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.64 -50.59 50.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.32 -55.07 32.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.913 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 68.1 m -54.23 -36.03 63.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.84 -46.53 87.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -29.83 52.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.38 -21.89 64.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.506 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 2.1 mttt -60.93 -63.08 4.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.562 0.696 . . . . 0.0 110.921 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.2 Cg_endo -69.78 -26.82 27.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.355 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.04 57.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 211' ' ' LEU . 2.8 tm? -72.07 -37.18 69.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.25 -50.85 66.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -31.06 57.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.838 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.44 -50.93 70.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' ARG . . . . . 0.426 ' HD3' HD21 ' A' ' 211' ' ' LEU . 0.0 OUTLIER -68.37 -35.84 78.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -57.06 -48.94 77.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.49 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.97 -29.78 72.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.459 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -32.66 74.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.85 0.357 . . . . 0.0 110.891 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.475 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -52.34 -61.67 4.23 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.3 Cg_endo -69.8 -43.85 2.38 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.28 . . . . 0.0 112.332 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 217' ' ' GLY . 54.1 t -57.27 -55.2 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.128 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.65 -33.25 71.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.955 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.631 ' O ' HG23 ' A' ' 227' ' ' VAL . 5.0 mt-10 -68.56 -34.86 76.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 70.6 m -59.96 -47.87 84.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -66.01 -41.93 90.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -45.13 87.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.93 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 223' ' ' GLU . 44.3 t -55.38 -42.82 69.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.152 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -49.94 75.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.841 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -64.78 -37.59 88.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.861 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.596 HD13 HD11 ' A' ' 233' ' ' LEU . 1.6 mm? -64.93 -34.52 78.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.08 -30.48 65.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.02 -50.84 53.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.109 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.596 HD11 HD13 ' A' ' 230' ' ' LEU . 1.4 pp -67.43 -35.57 79.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -39.51 69.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.91 -49.2 31.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -57.71 -41.44 81.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.966 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 80.5 m -65.8 -45.56 81.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.118 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.74 53.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 10.8 mtmm -57.78 -49.55 76.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.926 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.607 HD22 HG21 ' B' ' 197' ' ' THR . 0.5 OUTLIER -58.36 -35.11 71.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -70.31 -29.46 66.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.61 -68.19 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.102 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.894 -179.983 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.93 0.395 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 26.6 m -142.34 85.06 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.157 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -103.66 -179.88 4.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -39.15 64.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.876 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -68.44 -43.66 76.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.453 ' O ' HD23 ' B' ' 64' ' ' LEU . 4.7 mt -69.72 -35.62 75.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -66.72 -50.71 61.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -37.87 84.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.87 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.419 ' CA ' ' HB1' ' B' ' 232' ' ' ALA . 1.0 OUTLIER -73.63 -25.75 60.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 -179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.961 HD12 HG11 ' B' ' 67' ' ' VAL . 0.2 OUTLIER -53.53 -39.6 64.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 65' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' B' ' 67' ' ' VAL . . . 106.51 -162.0 13.89 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.508 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 33.01 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.717 2.278 . . . . 0.0 112.382 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' VAL . . . . . 0.961 HG11 HD12 ' B' ' 64' ' ' LEU . 18.2 m -75.82 -30.27 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 3.1 t -43.44 -38.59 2.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -58.26 -50.0 75.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -62.65 -54.73 35.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.87 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' TRP . . . . . 0.427 ' CD2' HD22 ' A' ' 189' ' ' LEU . 0.1 OUTLIER -63.68 -34.87 78.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.71 -54.15 17.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.847 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.04 -41.62 95.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.903 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.77 -55.16 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.28 -38.3 73.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -51.5 67.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.908 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' THR . . . . . 0.989 HG22 HD23 ' B' ' 82' ' ' LEU . 93.9 m -59.23 -21.96 60.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.141 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.24 -34.46 15.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.98 -27.15 20.96 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.509 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.989 HD23 HG22 ' B' ' 79' ' ' THR . 2.0 pp -48.39 -35.44 12.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 110.903 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -50.23 74.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -43.82 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.902 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.34 -49.33 74.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.74 -41.34 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.93 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -58.72 -50.48 73.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.92 -45.42 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.706 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -55.76 -47.04 77.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -50.21 73.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -48.12 70.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.866 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.81 -35.6 81.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.841 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 89' ' ' ASP . 67.9 t -65.68 -32.34 57.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.83 -53.07 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.893 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 -34.65 74.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.074 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -77.96 -33.48 51.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.909 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.94 -45.68 80.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.105 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.566 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.9 mt-30 -43.68 -66.16 0.49 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.566 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.8 -32.48 18.34 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.33 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' TYR . . . . . 0.419 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.0 t80 -58.76 -24.27 61.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.41 -50.07 15.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -59.87 -32.51 70.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.22 -47.11 62.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -55.84 -53.1 60.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.48 -47.66 78.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -60.87 -22.38 64.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -73.51 -47.54 40.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.401 ' CH2' ' HG3' ' A' ' 153' ' ' ARG . 0.1 OUTLIER -63.78 -31.81 73.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -64.03 -56.15 17.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.909 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -70.47 -34.26 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.73 -32.43 69.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -54.21 15.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.841 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.97 -35.6 81.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.67 -25.65 53.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.935 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.6 t80 -65.16 -54.84 23.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.13 -37.72 66.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -65.62 -24.35 67.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.923 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -88.02 -40.11 14.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 94.5 t -60.11 -32.75 51.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.153 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 4.7 mt-10 -58.45 -64.52 2.74 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.667 0.746 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.8 Cg_endo -69.78 -50.68 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.661 2.241 . . . . 0.0 112.304 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.21 -64.84 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 149' ' ' ARG . . . -45.39 -31.02 3.21 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.467 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -76.51 -44.52 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 110.918 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -70.44 -42.41 71.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 15.8 mmt -65.07 -53.35 47.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.885 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' B' ' 145' ' ' GLY . 1.6 tmm_? -61.16 -42.34 98.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.839 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -66.43 -51.87 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.79 -32.05 71.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.671 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.17 -47.52 76.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.085 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -45.32 91.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.33 -33.67 67.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.077 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -69.68 -50.19 46.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.671 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.8 p -65.14 -41.56 92.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 157' ' ' ASP . . . . . 0.428 ' N ' HG13 ' B' ' 156' ' ' VAL . 6.1 t70 -53.67 -52.06 61.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.45 75.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.436 ' O ' HD23 ' B' ' 163' ' ' LEU . 2.7 mp -56.92 -43.38 81.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.91 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -63.46 -44.37 94.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 25.1 m -56.25 -41.39 75.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.148 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -31.13 39.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.436 HD23 ' O ' ' B' ' 159' ' ' LEU . 1.8 mm? -70.13 -22.37 63.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.844 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.89 -62.86 3.53 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.579 0.704 . . . . 0.0 111.151 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.3 Cg_endo -69.76 -44.34 2.13 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.675 2.25 . . . . 0.0 112.337 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -58.66 -29.91 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.9 67.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.83 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.48 -33.51 76.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.73 -51.89 30.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 20.5 tp -67.18 -49.34 65.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.921 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.96 -36.22 70.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -67.63 -41.6 83.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -72.38 -40.75 67.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.18 -50.35 41.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.974 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.79 -40.73 80.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.21 -41.31 61.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.075 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -66.16 -34.01 77.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.864 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.56 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.2 tt -69.62 -49.72 51.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.933 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 179' ' ' GLU . . . . . 0.56 ' N ' HD23 ' B' ' 178' ' ' LEU . 77.0 mt-10 -69.27 -36.42 77.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.906 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -69.68 -49.14 56.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 2.2 tt -57.55 -41.81 81.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -71.73 -31.42 66.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.44 -55.27 33.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.862 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.55 -26.8 68.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.73 -34.58 44.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.462 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.52 -33.37 40.52 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.47 42.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.75 0.309 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -73.02 -32.62 65.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -39.63 93.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.22 36.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -49.5 75.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.04 -44.37 87.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.919 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -53.5 -49.39 67.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.29 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -49.65 16.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.59 -34.68 78.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 197' ' ' THR . . . . . 0.607 HG21 HD22 ' A' ' 240' ' ' LEU . 85.4 m -65.68 -47.56 75.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.113 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.49 -36.23 76.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.85 -46.39 87.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -30.16 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.01 -51.02 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.61 -50.61 50.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.37 -55.08 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 68.0 m -54.24 -36.06 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.86 -46.51 87.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -30.02 52.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.76 64.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.1 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.513 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 2.1 mttt -61.01 -63.23 4.57 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.586 0.708 . . . . 0.0 110.865 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.77 -26.8 27.15 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 0.0 112.31 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -31.98 57.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.488 ' C ' HD13 ' B' ' 211' ' ' LEU . 2.7 tm? -72.02 -37.18 69.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.13 -50.85 65.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.865 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.32 -31.16 58.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.32 -50.97 70.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.9 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 215' ' ' ARG . . . . . 0.43 ' HD3' HD21 ' B' ' 211' ' ' LEU . 0.0 OUTLIER -68.4 -35.9 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.869 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.07 -48.91 77.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.96 -29.78 72.4 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.494 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.18 -32.63 74.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 0.0 110.908 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.9 OUTLIER -52.39 -61.7 4.21 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.612 0.72 . . . . 0.0 110.885 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.69 -43.96 2.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.719 2.279 . . . . 0.0 112.364 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 217' ' ' GLY . 57.1 t -57.24 -55.15 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.109 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.72 -33.23 71.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.635 ' O ' HG23 ' B' ' 227' ' ' VAL . 5.0 mt-10 -68.49 -34.84 76.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 70.7 m -60.02 -47.85 84.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -65.84 -42.16 90.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -44.93 88.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.889 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.635 HG23 ' O ' ' B' ' 223' ' ' GLU . 42.9 t -55.46 -42.86 69.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.159 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.22 -49.96 75.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -64.69 -37.7 88.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.899 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.584 HD13 HD11 ' B' ' 233' ' ' LEU . 1.6 mm? -64.86 -34.5 78.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.943 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.1 -30.51 65.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 232' ' ' ALA . . . . . 0.419 ' HB1' ' CA ' ' B' ' 63' ' ' GLN . . . -67.96 -50.86 53.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.075 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.584 HD11 HD13 ' B' ' 230' ' ' LEU . 1.4 pp -67.41 -35.64 79.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.0 -39.61 69.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.81 -49.15 32.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.897 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -57.79 -41.45 82.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.908 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 81.3 m -65.77 -45.53 82.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.76 53.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 10.7 mtmm -57.82 -49.51 76.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.602 HD22 HG21 ' A' ' 197' ' ' THR . 0.5 OUTLIER -58.48 -35.02 71.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -70.24 -29.51 66.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.62 -68.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.125 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 -179.972 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.954 0.407 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.84 169.59 14.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.092 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -143.59 175.79 9.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -67.36 -41.18 85.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.483 ' O ' ' HB1' ' A' ' 232' ' ' ALA . 8.9 pttm -67.94 -40.79 83.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.912 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.505 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -71.74 -34.26 69.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.891 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -67.7 -50.94 55.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.884 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -66.63 -44.95 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.64 -22.6 66.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.978 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.59 HD12 HG11 ' A' ' 67' ' ' VAL . 0.2 OUTLIER -55.44 -32.38 62.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.896 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.413 ' C ' ' H ' ' A' ' 67' ' ' VAL . . . 116.41 -161.69 12.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.511 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 41.04 0.32 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.673 2.249 . . . . 0.0 112.344 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.59 HG11 HD12 ' A' ' 64' ' ' LEU . 22.6 m -77.09 -30.18 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.108 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 97.2 m -44.63 -35.96 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.143 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.49 -50.87 71.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -70.96 -27.65 63.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.89 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -63.87 -60.51 3.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.46 ' HB2' HD22 ' B' ' 189' ' ' LEU . 6.6 p-90 -64.94 -35.0 79.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.931 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.66 -53.77 25.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -66.68 -36.85 83.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.07 -55.25 27.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.53 -38.7 81.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.941 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.07 -50.94 69.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.21 -32.62 61.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.872 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.9 m -65.92 -23.92 66.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.47 -33.66 22.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.98 -30.73 54.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.487 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.678 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.9 tm? -51.73 -36.31 46.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.807 0.336 . . . . 0.0 110.932 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -49.79 75.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -41.3 96.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -48.34 81.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -40.05 96.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -50.6 73.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.78 -46.01 91.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.92 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.717 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.2 t70 -56.1 -47.59 77.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -51.47 69.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -47.8 65.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.26 -38.41 91.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 89' ' ' ASP . 88.7 t -65.0 -31.75 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -74.96 -54.26 7.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.2 -30.16 70.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.156 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -79.0 -36.64 40.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.03 -45.0 83.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.122 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.552 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.3 mm-40 -43.84 -65.43 0.59 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.578 0.704 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.552 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 54.0 Cg_endo -69.76 -25.63 28.38 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.639 2.226 . . . . 0.0 112.367 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -53.56 -58.14 8.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -54.92 -28.57 51.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.02 -47.62 73.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -44.19 87.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.863 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -50.52 72.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.89 -47.35 86.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -60.93 -26.24 67.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.927 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -45.27 62.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.895 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' TRP . . . . . 0.55 ' HE1' ' NH1' ' B' ' 149' ' ' ARG . 0.0 OUTLIER -69.96 -23.3 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -68.12 -64.48 0.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -62.94 -34.97 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.64 -30.32 66.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.924 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 45.3 ttp -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.9 -41.31 97.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -24.79 55.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.958 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.767 ' O ' HG23 ' A' ' 119' ' ' VAL . 6.6 t80 -63.66 -55.05 26.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -69.95 -42.72 72.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.33 -26.61 67.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.876 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -89.63 -37.81 14.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 115' ' ' TYR . 50.8 t -58.47 -31.73 43.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -60.91 -64.78 2.71 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.67 0.748 . . . . 0.0 110.903 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.75 -51.03 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.677 2.251 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.9 -63.48 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.11 -30.72 1.9 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.524 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.32 -43.72 60.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.859 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -74.95 -33.92 61.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -48.65 68.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.4 ' NH1' ' HE1' ' B' ' 108' ' ' TRP . 0.9 OUTLIER -69.21 -37.15 77.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -71.0 -50.82 30.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.7 -37.97 89.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.13 -43.51 98.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -62.18 -50.62 71.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.29 -30.29 69.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.118 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 35.7 t60 -68.36 -50.44 53.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.848 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.9 p -66.65 -37.26 79.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.161 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -57.2 -52.94 63.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.91 -49.15 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.549 ' O ' HD23 ' A' ' 163' ' ' LEU . 6.2 mt -56.43 -49.57 74.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.47 ' HB3' HD22 ' B' ' 101' ' ' LEU . 23.5 mmt-85 -60.17 -39.4 86.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 95.0 m -57.3 -48.04 79.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -76.14 -35.14 59.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.64 62.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.19 -62.43 5.98 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 0.0 111.133 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.8 -41.37 4.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.73 2.286 . . . . 0.0 112.323 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -61.57 -34.73 76.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.6 t -60.99 -45.76 93.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -62.56 -50.92 69.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.859 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.32 -51.43 69.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.551 ' C ' HD13 ' A' ' 170' ' ' LEU . 1.7 tm? -63.25 -46.57 86.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ARG . . . . . 0.405 ' HG3' HD11 ' B' ' 90' ' ' LEU . 1.8 tpt85 -60.39 -38.09 82.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -34.65 78.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.14 -49.0 60.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.77 -50.92 30.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.945 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.2 -45.84 72.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.35 -36.03 71.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -32.35 72.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.415 ' O ' HD12 ' A' ' 178' ' ' LEU . 4.8 tp -72.26 -50.88 23.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.48 -45.0 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.69 93.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 55.4 tp -58.81 -40.87 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -66.26 -31.82 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -55.3 33.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -65.74 -26.23 67.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.19 -33.66 38.55 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.502 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.23 -32.7 37.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.507 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.22 42.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.738 0.304 . . . . 0.0 111.078 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -72.91 -34.36 66.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.882 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.507 HD22 ' HB2' ' B' ' 72' ' ' TRP . 0.0 OUTLIER -62.5 -37.67 86.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.58 36.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.01 -48.77 77.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.892 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.27 -43.93 92.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' ' 197' ' ' THR . 85.1 t60 -53.27 -50.58 64.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.851 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.15 69.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -49.31 18.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.55 -36.72 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.081 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 197' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 193' ' ' HIS . 21.1 p -63.17 -47.58 82.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.148 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -35.96 80.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.55 -45.95 87.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.64 -30.24 65.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.943 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -50.9 71.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 54.3 m -68.18 -50.15 56.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.11 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.58 -54.05 46.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 67.0 m -54.59 -36.14 64.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.61 -47.78 83.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.905 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.2 -28.07 48.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.845 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.16 -22.08 63.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.152 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.494 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -60.22 -62.59 5.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.577 0.703 . . . . 0.0 110.908 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.494 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.81 -27.11 26.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.274 . . . . 0.0 112.354 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.82 -30.94 56.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.126 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.99 -37.52 66.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.879 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.06 -50.81 65.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.885 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.01 -30.71 61.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -51.35 70.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -37.18 81.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.73 -49.09 76.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.483 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.19 -29.42 73.3 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -62.98 -32.93 74.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 110.928 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -52.17 -61.77 4.03 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.583 0.706 . . . . 0.0 110.935 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.72 -43.74 2.52 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.703 2.269 . . . . 0.0 112.338 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 217' ' ' GLY . 52.9 t -57.26 -53.69 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.182 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.63 -33.52 71.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 227' ' ' VAL . 1.8 tt0 -65.0 -36.0 82.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 47.7 t -61.84 -48.32 81.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.13 -41.06 82.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.919 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.76 -45.44 86.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.929 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 223' ' ' GLU . 28.9 t -56.8 -41.57 75.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.148 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.96 -50.12 75.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.05 -38.08 84.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.403 ' HA ' HD21 ' A' ' 233' ' ' LEU . 0.4 OUTLIER -62.09 -35.87 79.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.48 -30.53 67.36 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 232' ' ' ALA . . . . . 0.483 ' HB1' ' O ' ' A' ' 59' ' ' LYS . . . -66.84 -51.29 57.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.1 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 230' ' ' LEU . 0.8 OUTLIER -70.12 -41.05 74.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.29 -43.4 98.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.28 -47.57 76.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.85 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -53.99 -39.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 13.0 m -67.04 -44.8 79.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.11 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -55.5 33.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.31 -49.07 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -57.84 -39.81 78.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.859 179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -84.55 109.63 18.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 12.1 p -60.22 -74.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.03 169.64 14.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.66 176.26 9.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.894 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -67.88 -41.07 83.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.836 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.494 ' O ' ' HB1' ' B' ' 232' ' ' ALA . 8.9 pttm -68.02 -40.78 82.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.502 ' O ' HD23 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -71.73 -34.33 69.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -67.75 -50.91 54.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.906 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -66.58 -44.92 80.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.933 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.73 -22.6 66.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.586 HD12 HG11 ' B' ' 67' ' ' VAL . 0.2 OUTLIER -55.51 -32.22 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.921 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 65' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' B' ' 67' ' ' VAL . . . 116.24 -161.73 12.86 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.489 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 41.02 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.669 2.246 . . . . 0.0 112.36 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' VAL . . . . . 0.586 HG11 HD12 ' B' ' 64' ' ' LEU . 22.5 m -77.01 -30.13 17.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.147 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 97.0 m -44.72 -35.88 2.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.55 -50.79 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.954 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -71.02 -27.67 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -63.83 -60.48 3.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' TRP . . . . . 0.507 ' HB2' HD22 ' A' ' 189' ' ' LEU . 6.5 p-90 -65.01 -34.87 79.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.88 -53.67 24.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.889 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -66.67 -36.78 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.2 tp -63.14 -55.26 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.92 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.52 -38.71 81.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.04 -50.96 69.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.947 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -75.18 -32.69 61.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.885 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -65.77 -23.91 66.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.4 -33.63 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.95 -30.79 54.66 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.669 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.7 tm? -51.68 -36.42 46.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.8 0.333 . . . . 0.0 110.931 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -49.78 75.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.825 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -41.49 97.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -48.61 80.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -40.22 96.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -50.4 73.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.49 -46.73 88.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.721 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.1 t70 -55.85 -47.91 76.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.9 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.405 HD11 ' HG3' ' A' ' 171' ' ' ARG . 0.4 OUTLIER -57.8 -51.57 69.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.86 -47.96 64.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.45 -37.31 86.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 89' ' ' ASP . 88.6 t -65.7 -32.03 56.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.163 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -75.08 -55.49 5.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.945 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.98 -31.75 70.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.068 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt -78.78 -37.44 41.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.6 t -51.79 -51.6 26.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.576 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mm-40 -39.88 -67.27 0.29 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 110.895 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.576 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.76 -20.65 34.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 0.0 112.37 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.48 -55.55 24.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 160' ' ' ARG . 1.4 pp -62.24 -28.39 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.969 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -49.23 78.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.07 -43.84 77.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.814 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.25 -50.81 71.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.844 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.7 -47.71 84.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -59.53 -25.41 64.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.39 -47.34 50.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.962 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' TRP . . . . . 0.4 ' HE1' ' NH1' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -66.56 -25.92 66.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 179.922 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -67.51 -65.58 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -60.97 -35.65 77.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.41 -29.9 66.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.886 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 39.3 ttp -65.63 -51.13 61.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.06 -41.27 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mp -75.83 -24.65 55.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.732 ' O ' HG23 ' B' ' 119' ' ' VAL . 8.4 t80 -63.74 -55.09 25.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -71.14 -39.55 71.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -25.67 68.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -91.8 -39.11 11.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.732 HG23 ' O ' ' B' ' 115' ' ' TYR . 45.0 t -58.85 -31.29 44.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.148 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.531 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -61.58 -64.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.662 0.744 . . . . 0.0 110.889 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.531 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.76 -50.61 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -63.82 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.63 -30.35 1.46 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.502 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.61 -45.0 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.815 0.34 . . . . 0.0 110.907 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -74.56 -35.78 63.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.37 47.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.55 ' NH1' ' HE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -65.57 -36.83 84.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.876 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.47 -50.72 50.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 2.8 ttp85 -64.14 -34.44 78.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.38 70.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -56.67 -50.04 73.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.97 70.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.11 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -68.75 -49.98 54.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.03 -36.76 78.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.71 -52.06 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.47 -49.51 68.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.556 ' O ' HD23 ' B' ' 163' ' ' LEU . 6.2 mt -56.8 -48.03 78.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.82 -40.12 91.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 92.5 m -57.47 -46.69 83.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.141 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -76.49 -35.73 58.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.76 62.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.78 -62.17 6.5 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.571 0.7 . . . . 0.0 111.108 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.6 Cg_endo -69.79 -42.24 3.54 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.663 2.242 . . . . 0.0 112.336 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -60.81 -33.55 73.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.4 t -61.49 -46.22 90.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.821 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -62.41 -48.9 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.96 -51.87 67.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 11.3 tp -61.2 -49.19 78.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -62.31 -34.56 76.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.7 -34.77 79.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -47.11 57.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.0 tp -70.17 -51.12 33.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.08 -45.12 75.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.3 -34.81 70.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.125 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -32.5 71.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.886 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.421 ' O ' HD12 ' B' ' 178' ' ' LEU . 4.9 tp -71.76 -50.22 31.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -67.35 -43.21 82.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.893 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.39 90.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.079 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 54.9 tp -60.03 -38.28 82.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -69.67 -32.22 70.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -55.13 35.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.885 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.62 -26.15 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.14 -33.75 38.36 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.481 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.12 -32.8 36.38 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.502 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.17 42.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.116 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -73.03 -34.29 66.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.836 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.46 HD22 ' HB2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -62.5 -37.71 87.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.02 -49.39 37.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.119 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.06 -48.7 77.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.42 -43.77 92.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.892 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 193' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 197' ' ' THR . 85.0 t60 -53.46 -50.42 65.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.851 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.03 -31.17 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.082 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.63 -49.24 19.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.79 83.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.091 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 197' ' ' THR . . . . . 0.481 HG23 ' O ' ' B' ' 193' ' ' HIS . 21.2 p -63.12 -47.45 82.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.168 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -35.94 80.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.87 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.65 -45.89 88.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.844 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.62 -30.28 65.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -50.94 71.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.836 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 54.1 m -68.14 -50.07 57.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.164 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.64 -53.93 48.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.953 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 66.7 m -54.75 -36.07 64.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.868 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.67 -47.77 83.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.17 -28.03 48.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.9 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.12 63.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.503 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -60.13 -62.66 5.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.524 0.678 . . . . 0.0 110.927 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.3 Cg_endo -69.81 -27.06 26.72 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.666 2.244 . . . . 0.0 112.338 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.92 -30.88 56.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.094 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.08 -37.41 66.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -53.89 -50.81 65.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -30.92 61.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.65 -51.57 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.898 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -37.57 82.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.68 -49.07 76.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.496 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.88 -29.51 73.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.49 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.03 -32.79 74.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.939 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.3 mp -52.18 -61.74 4.07 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.609 0.719 . . . . 0.0 110.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.77 -43.69 2.5 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.671 2.247 . . . . 0.0 112.325 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 217' ' ' GLY . 54.6 t -57.27 -53.86 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.106 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.5 -33.55 71.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.566 ' O ' HG23 ' B' ' 227' ' ' VAL . 1.8 tt0 -64.93 -35.91 82.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.889 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 47.8 t -61.97 -48.3 80.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -68.13 -41.07 82.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.8 -45.49 86.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.887 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 223' ' ' GLU . 27.3 t -56.71 -41.65 75.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.105 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.02 -50.07 75.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.828 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -38.15 85.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' B' ' 233' ' ' LEU . 0.4 OUTLIER -62.07 -35.85 79.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.47 -30.53 67.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 232' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' B' ' 59' ' ' LYS . . . -66.83 -51.41 55.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.09 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' B' ' 230' ' ' LEU . 0.8 OUTLIER -69.94 -41.15 74.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.26 -43.55 97.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.866 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.22 -47.51 76.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -54.03 -39.2 65.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.92 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 12.9 m -66.96 -44.68 79.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.164 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -55.6 31.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.874 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.2 -49.08 78.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.551 HD13 ' O ' ' B' ' 240' ' ' LEU . 0.4 OUTLIER -57.83 -39.78 78.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.9 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -84.57 109.69 18.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 12.3 p -60.3 -74.34 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.118 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.901 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.92 0.391 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 11.7 t -98.87 154.67 17.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.149 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.38 159.06 42.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 m -72.22 -36.05 69.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.862 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -62.72 -43.0 99.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.911 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -34.35 77.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.904 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmt180 -69.05 -53.81 18.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.845 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.62 -35.63 81.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.547 ' CA ' ' HB1' ' A' ' 232' ' ' ALA . 0.4 OUTLIER -77.29 -24.83 50.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.569 HD22 ' HB ' ' A' ' 67' ' ' VAL . 0.7 OUTLIER -51.34 -44.17 61.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 91.61 -153.33 22.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -6.21 18.07 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.569 ' HB ' HD22 ' A' ' 64' ' ' LEU . 63.5 t -60.9 -30.19 46.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.133 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 9.1 t -45.87 -35.15 4.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.81 -48.65 80.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.912 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -69.54 -32.52 71.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -65.14 -52.39 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.91 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.413 ' CE3' HD22 ' B' ' 189' ' ' LEU . 0.0 OUTLIER -65.03 -35.92 82.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.903 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -64.77 -52.87 54.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -69.58 -35.36 75.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.783 ' O ' HG23 ' A' ' 79' ' ' THR . 9.3 tp -62.33 -55.4 28.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.26 -33.28 75.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -44.37 81.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.17 -37.48 63.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 75' ' ' LEU . 36.3 p -61.84 -21.04 64.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.099 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.09 -31.7 8.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.82 -29.85 43.01 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.466 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 82' ' ' LEU . 2.0 tm? -51.17 -35.25 35.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.845 0.355 . . . . 0.0 110.947 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -50.1 74.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.92 -40.87 95.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -47.41 85.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -40.79 98.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.86 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.409 ' HA ' HD12 ' A' ' 90' ' ' LEU . 2.9 m -58.32 -50.68 72.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.866 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -45.27 95.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.92 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.718 ' O ' HG23 ' A' ' 93' ' ' VAL . 1.0 OUTLIER -56.52 -48.01 78.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 87' ' ' SER . 8.8 mt -57.5 -51.61 68.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.15 -47.86 65.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -63.74 -36.8 85.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.852 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.718 HG23 ' O ' ' A' ' 89' ' ' ASP . 77.6 t -65.8 -32.11 56.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.087 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -74.94 -54.28 7.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.39 71.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.118 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.89 -35.94 42.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.56 -44.79 85.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.118 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.548 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.4 mt-30 -43.81 -65.18 0.62 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.584 0.707 . . . . 0.0 110.894 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.3 Cg_endo -69.71 -26.22 28.02 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.341 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -52.93 -58.48 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' B' ' 160' ' ' ARG . 1.3 pp -54.83 -27.84 45.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -43.81 85.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.87 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -71.97 -37.26 69.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.68 -53.23 58.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.894 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -42.86 98.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -62.56 -28.05 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.89 -45.79 60.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -24.01 64.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -66.75 -65.22 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.62 -35.47 77.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -71.1 -29.77 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -64.42 -51.29 63.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.883 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.48 -41.02 98.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.69 -24.12 56.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 119' ' ' VAL . 7.5 t80 -63.68 -55.76 20.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -63.44 -24.88 68.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.892 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -92.73 -32.99 14.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 115' ' ' TYR . 42.6 t -62.6 -32.07 54.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.158 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 9.4 tt0 -63.28 -61.7 6.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.3 Cg_endo -69.77 -51.21 0.4 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.702 2.268 . . . . 0.0 112.329 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.68 -62.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.937 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.72 -30.72 1.61 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.474 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.79 -43.73 53.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.804 0.335 . . . . 0.0 110.855 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -37.4 64.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -48.99 67.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.9 tpp85 -67.77 -38.4 83.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.868 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -70.42 -50.87 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -38.06 89.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.839 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -62.53 -43.74 98.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.058 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -60.96 -51.25 70.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.857 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.02 -29.97 69.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.117 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -67.85 -51.07 52.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 152' ' ' ALA . 8.2 p -65.84 -39.47 84.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.141 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.61 -52.56 61.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.82 -48.3 74.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.108 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -42.57 78.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.514 ' HB3' HD13 ' B' ' 101' ' ' LEU . 1.5 mpt_? -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.832 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.8 -47.49 82.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.112 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -78.83 -35.51 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.8 tt -71.68 -15.4 62.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.25 -62.69 5.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 0.0 111.142 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.76 -40.81 4.89 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' TYR . . . . . 0.48 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 14.4 t80 -61.92 -34.64 76.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -61.27 -46.19 91.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.874 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.54 -48.95 78.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.889 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.08 -52.01 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.48 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 12.4 tp -59.58 -50.14 75.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ARG . . . . . 0.528 HH21 HG11 ' B' ' 93' ' ' VAL . 7.2 mmm180 -63.71 -34.38 77.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.9 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -62.73 -35.38 79.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.19 -50.82 24.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.96 -51.72 56.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.916 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.91 -44.83 74.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.061 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.71 -35.09 70.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -65.84 -33.1 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 178' ' ' LEU . 1.4 tp -73.8 -51.06 17.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.74 -50.33 65.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.83 -47.74 79.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.119 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 59.1 tp -56.81 -40.03 75.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -65.94 -32.73 74.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -55.0 37.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -67.78 -26.13 65.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.9 -33.95 36.93 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.491 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.86 36.17 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.462 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.76 43.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.766 0.317 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -73.27 -35.89 66.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.485 HD22 ' CE3' ' B' ' 72' ' ' TRP . 0.3 OUTLIER -62.29 -37.44 85.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.882 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.96 -49.01 41.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.164 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -50.75 71.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.91 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.12 -42.22 85.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -53.95 -49.49 68.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.12 70.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.56 -49.91 17.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.26 79.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' THR . . . . . 0.93 HG23 HD13 ' B' ' 240' ' ' LEU . 59.3 m -64.21 -47.79 78.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.147 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -36.74 80.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.857 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -58.93 -43.8 91.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.34 -31.02 65.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -50.94 71.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 23.1 p -67.72 -50.41 57.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.113 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.59 -52.69 61.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 27.5 t -55.23 -35.84 65.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.848 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.87 -48.07 82.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -29.18 50.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.43 -21.55 63.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.111 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.497 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 1.8 mtpp -59.86 -62.54 5.69 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.615 0.722 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.71 -27.26 26.92 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 0.0 112.343 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.5 -31.85 57.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.121 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.495 ' C ' HD13 ' A' ' 211' ' ' LEU . 3.0 tm? -72.8 -37.46 67.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.85 -51.33 63.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.78 61.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.97 -50.8 70.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.945 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.23 -37.48 85.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.829 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -56.52 -48.31 77.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.926 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.538 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.81 -28.39 73.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.508 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 23.3 tp -66.07 -33.33 75.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.83 0.348 . . . . 0.0 110.931 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.9 tp -49.98 -60.13 5.69 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 0.0 110.911 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.1 Cg_endo -69.77 -39.56 6.34 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.692 2.261 . . . . 0.0 112.345 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.7 t -58.35 -54.49 32.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.02 -34.88 73.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 227' ' ' VAL . 10.2 tt0 -64.85 -35.17 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.882 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.03 -48.54 79.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.85 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -40.76 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.862 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.21 -47.7 78.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 223' ' ' GLU . 37.7 t -56.79 -40.17 69.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.153 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.64 -50.18 74.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -61.34 -38.65 87.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.885 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.774 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -63.43 -35.28 79.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.896 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 8.8 m -69.9 -30.15 67.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 232' ' ' ALA . . . . . 0.547 ' HB1' ' CA ' ' A' ' 63' ' ' GLN . . . -68.9 -50.96 45.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.11 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.774 HD11 HD13 ' A' ' 230' ' ' LEU . 1.0 OUTLIER -69.25 -42.05 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.0 -38.82 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.66 -47.3 63.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 236' ' ' TYR . . . . . 0.699 ' CZ ' HD11 ' A' ' 240' ' ' LEU . 11.1 t80 -54.07 -39.23 66.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.892 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' O ' ' A' ' 233' ' ' LEU . 36.5 p -69.27 -45.63 69.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.149 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.41 -54.3 42.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.92 -36.3 81.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.877 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.939 HD13 HG23 ' B' ' 197' ' ' THR . 9.5 mt -57.57 -40.94 80.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 176.75 98.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 53.0 m -163.35 -43.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.113 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.926 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.966 0.412 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 11.8 t -97.72 153.51 18.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.133 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.44 160.66 43.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.7 m -73.8 -37.1 65.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.844 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -62.41 -42.3 99.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.926 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -34.45 77.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -69.32 -53.67 18.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.908 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.64 -35.8 81.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.619 ' CA ' ' HB1' ' B' ' 232' ' ' ALA . 0.4 OUTLIER -77.31 -24.49 50.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.93 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.574 HD22 ' HB ' ' B' ' 67' ' ' VAL . 0.7 OUTLIER -51.29 -43.88 61.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 91.1 -153.58 22.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.479 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -6.25 18.13 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.686 2.257 . . . . 0.0 112.33 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' VAL . . . . . 0.574 ' HB ' HD22 ' B' ' 64' ' ' LEU . 64.0 t -60.97 -30.11 46.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.11 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 9.0 t -45.96 -35.2 4.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -48.59 80.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -69.59 -32.53 71.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.854 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -65.15 -52.34 55.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.883 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' TRP . . . . . 0.485 ' CE3' HD22 ' A' ' 189' ' ' LEU . 0.0 OUTLIER -65.11 -35.93 82.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.859 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 11.9 t0 -64.74 -52.8 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -69.68 -35.38 75.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.891 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.777 ' O ' HG23 ' B' ' 79' ' ' THR . 9.3 tp -62.2 -55.42 28.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -33.29 75.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.887 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.909 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.09 -37.94 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' THR . . . . . 0.777 HG23 ' O ' ' B' ' 75' ' ' LEU . 36.8 p -61.33 -20.94 63.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.108 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.08 -31.8 8.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.74 -29.9 42.45 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.682 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.9 tm? -51.17 -35.33 35.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 110.945 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -50.12 74.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.79 -40.95 96.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.02 -47.73 84.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -40.56 98.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' SER . . . . . 0.412 ' HA ' HD12 ' B' ' 90' ' ' LEU . 2.9 m -58.24 -50.52 73.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -45.47 93.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.882 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.41 -48.27 77.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.896 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' B' ' 87' ' ' SER . 8.0 mt -57.38 -51.6 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.86 -47.87 64.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -64.14 -36.08 82.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.3 t -66.44 -32.16 56.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 2.2 tmtt? -75.28 -55.27 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.73 70.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.135 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -78.85 -36.68 41.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.5 t -52.76 -50.59 41.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.573 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mt-30 -40.77 -66.75 0.35 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.533 0.682 . . . . 0.0 110.926 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.9 Cg_endo -69.78 -21.72 33.0 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.675 2.25 . . . . 0.0 112.349 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -52.89 -56.14 18.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.875 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.514 HD13 ' HB3' ' A' ' 160' ' ' ARG . 1.2 pp -61.19 -28.19 68.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.907 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -45.9 90.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.844 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -73.09 -38.0 66.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.09 -53.5 56.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.874 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -42.66 99.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.873 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -61.84 -26.99 68.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -72.79 -47.94 42.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -26.67 68.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.24 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.11 -35.52 77.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -71.22 -29.46 65.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -64.44 -50.67 66.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -64.19 -40.22 95.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.26 -24.76 57.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.739 ' O ' HG23 ' B' ' 119' ' ' VAL . 18.1 t80 -65.18 -55.66 17.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.916 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -39.47 83.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -66.2 -24.95 66.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -92.24 -37.79 12.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.923 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.739 HG23 ' O ' ' B' ' 115' ' ' TYR . 52.1 t -60.4 -31.86 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.125 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.516 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.4 mt-10 -61.85 -63.86 3.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 0.0 110.872 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.73 -50.39 0.47 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.276 . . . . 0.0 112.363 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -63.89 1.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.99 -30.16 1.67 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.5 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.31 -44.34 37.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.866 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -44.36 61.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.859 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -51.78 62.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -61.62 -42.04 98.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.68 -50.49 62.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -33.78 75.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.63 -50.75 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.074 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -55.98 -50.34 71.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.881 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.66 -30.87 70.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.109 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -67.92 -50.63 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.35 -39.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -54.66 -52.28 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.97 -48.27 74.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.062 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.76 -42.38 79.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' ARG . . . . . 0.468 ' HB3' HD13 ' A' ' 101' ' ' LEU . 7.7 mpt_? -66.41 -39.18 88.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.79 -47.29 82.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.155 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -79.03 -35.35 42.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.829 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.9 tt -71.76 -15.93 62.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.887 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.65 -62.66 5.52 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.605 0.717 . . . . 0.0 111.122 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.75 -40.15 5.67 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 0.0 112.356 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 166' ' ' TYR . . . . . 0.413 ' CZ ' HD22 ' B' ' 170' ' ' LEU . 14.4 t80 -62.71 -34.32 76.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.892 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -61.35 -46.45 90.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.86 -48.16 81.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.44 -51.86 63.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' B' ' 166' ' ' TYR . 12.4 tp -60.08 -49.56 77.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 171' ' ' ARG . . . . . 0.414 HH21 HG11 ' A' ' 93' ' ' VAL . 7.2 mmm180 -63.89 -34.29 77.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.76 -35.73 80.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.03 -50.82 25.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -51.58 58.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.25 -44.31 75.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.113 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.82 -35.05 69.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -65.25 -33.86 77.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.431 ' O ' HD12 ' B' ' 178' ' ' LEU . 1.5 tp -73.52 -50.53 20.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.925 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.32 -47.55 76.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -60.04 -48.74 80.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 57.9 tp -57.3 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -70.36 -33.7 71.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -54.16 47.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.846 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -67.95 -25.95 65.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.85 -33.87 36.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.516 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.03 -32.19 34.45 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.46 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.32 -25.51 42.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.327 . . . . 0.0 111.102 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 8.3 ttp180 -73.01 -36.81 67.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.897 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.413 HD22 ' CE3' ' A' ' 72' ' ' TRP . 0.3 OUTLIER -61.54 -37.26 83.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.935 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.91 -48.82 42.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.094 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -51.29 69.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -57.91 -42.48 84.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -53.52 -49.67 67.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.85 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.29 -31.05 70.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -75.51 -49.87 17.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.909 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.39 -35.44 79.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.118 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 197' ' ' THR . . . . . 0.939 HG23 HD13 ' A' ' 240' ' ' LEU . 56.5 m -64.02 -47.72 79.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -36.76 80.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.892 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -58.97 -43.57 91.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.51 -31.05 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -50.87 71.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 23.2 p -67.66 -50.41 57.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 26.7 tp -54.68 -52.65 61.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.882 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 27.7 t -55.25 -35.79 65.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.839 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.96 -48.04 82.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.87 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.18 50.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.58 -21.41 63.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 1.8 mtpp -59.98 -62.53 5.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.555 0.693 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.5 Cg_endo -69.78 -27.24 26.61 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.686 2.257 . . . . 0.0 112.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.58 -31.87 57.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' B' ' 211' ' ' LEU . 3.0 tm? -72.66 -37.5 67.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.94 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.88 -51.17 64.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.77 61.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.81 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -62.09 -50.85 70.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.15 -37.49 85.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.842 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -56.45 -48.37 77.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.563 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.76 -28.37 73.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.494 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 23.4 tp -66.12 -33.32 75.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.9 tp -50.07 -60.03 5.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.598 0.713 . . . . 0.0 110.918 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.9 Cg_endo -69.76 -39.63 6.28 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.662 2.241 . . . . 0.0 112.369 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.36 -54.51 31.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.161 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.01 -34.87 73.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.536 ' O ' HG23 ' B' ' 227' ' ' VAL . 10.2 tt0 -64.9 -35.11 80.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.863 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.09 -48.52 79.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.854 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -40.87 76.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.927 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.16 -47.75 78.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.902 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.536 HG23 ' O ' ' B' ' 223' ' ' GLU . 37.7 t -56.74 -40.21 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.136 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.18 74.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -61.35 -38.6 87.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.785 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -63.38 -35.45 80.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 8.6 m -69.78 -30.22 67.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 232' ' ' ALA . . . . . 0.619 ' HB1' ' CA ' ' B' ' 63' ' ' GLN . . . -68.95 -50.86 45.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.122 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.785 HD11 HD13 ' B' ' 230' ' ' LEU . 1.0 OUTLIER -69.28 -42.12 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -38.73 92.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.892 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.71 -47.26 63.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 236' ' ' TYR . . . . . 0.689 ' CZ ' HD11 ' B' ' 240' ' ' LEU . 11.3 t80 -54.17 -39.13 66.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 237' ' ' THR . . . . . 0.717 HG23 ' O ' ' B' ' 233' ' ' LEU . 35.9 p -69.32 -45.63 69.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.135 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -54.47 -54.24 43.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.84 -36.35 82.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.931 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.93 HD13 HG23 ' A' ' 197' ' ' THR . 9.4 mt -57.52 -40.89 79.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 176.7 98.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.94 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 53.3 m -163.38 -42.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.989 0.423 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.3 p -134.0 89.29 2.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.138 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -167.06 -43.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -64.31 -37.26 86.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -70.78 -46.35 63.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.57 -35.91 79.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -47.97 67.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.882 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.53 -33.98 71.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.902 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -75.28 -29.73 60.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.492 HD13 ' C ' ' A' ' 64' ' ' LEU . 3.1 tm? -53.38 -45.75 69.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 172.32 157.41 14.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.481 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -90.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 0.0 112.312 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -58.98 -33.22 49.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.129 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.4 m -59.32 -39.86 84.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -64.39 -51.83 61.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.99 -29.67 71.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -66.33 -67.15 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -57.99 -32.48 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -71.51 -48.32 49.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.919 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.63 -49.84 75.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.901 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.5 -57.04 10.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.12 -33.79 58.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.63 -52.85 55.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -27.83 65.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.0 m -58.61 -26.9 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -50.87 -47.44 60.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.93 -29.26 19.52 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.514 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.1 tm? -49.83 -43.21 48.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 0.0 110.933 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.9 ttt180 -58.03 -49.42 76.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.79 88.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.897 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.26 -49.95 72.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -42.54 81.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.77 -50.5 73.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.838 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -43.56 89.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -57.16 -48.49 78.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.2 tp -57.01 -49.87 74.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.28 -48.0 71.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.43 -35.98 82.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 64.9 t -65.39 -32.83 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.092 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -74.5 -52.63 11.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.76 -32.58 72.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -77.98 -33.57 51.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -58.98 -43.29 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.537 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.4 OUTLIER -43.95 -64.93 0.67 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.59 0.709 . . . . 0.0 110.911 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.69 -30.31 22.81 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 0.0 112.371 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -58.25 -27.44 63.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -50.71 28.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -33.79 76.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.48 -48.12 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.838 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -56.59 -52.57 64.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -45.7 84.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -62.9 -22.71 66.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -72.95 -47.73 42.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -30.0 70.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -56.23 15.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.97 -34.39 71.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -69.51 -34.41 74.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 23.5 ttp -68.84 -54.29 16.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -64.29 -35.78 81.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.67 -26.06 54.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.7 t80 -62.81 -55.35 27.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -35.14 62.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 tt0 -68.02 -23.95 65.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -85.82 -43.85 12.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 60.6 t -59.39 -32.47 48.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.55 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 mm-40 -56.54 -65.58 1.57 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.663 0.744 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.74 -52.3 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.637 2.224 . . . . 0.0 112.357 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.24 -65.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.27 -33.95 2.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -76.22 -44.77 36.14 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.88 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -66.86 -43.52 83.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -47.13 73.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -64.99 -42.34 94.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.84 -53.08 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.26 -38.53 83.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.862 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.75 -42.02 99.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -60.21 -53.26 59.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.01 50.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -56.95 -46.03 82.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 5.1 t -59.33 -52.5 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.172 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.36 -52.37 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.845 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.38 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.134 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.19 -44.26 87.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -67.54 -43.99 79.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 23.9 m -55.84 -42.1 75.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.171 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 -33.89 30.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.13 -23.19 62.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -55.49 -62.57 4.24 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.577 0.703 . . . . 0.0 111.043 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.0 Cg_endo -69.72 -43.13 2.87 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.709 2.273 . . . . 0.0 112.324 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -60.9 -28.99 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 12.7 t -59.67 -51.82 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.818 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.29 -48.93 68.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.65 -51.58 68.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.472 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.3 tm? -61.06 -46.57 90.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.875 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -42.96 81.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -34.46 78.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -49.76 57.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -50.58 45.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.94 -35.58 64.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.34 -34.32 55.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.118 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -48.28 81.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.6 pp -68.83 -49.18 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.513 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.2 OUTLIER -58.76 -50.53 73.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.59 87.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.136 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 52.7 tp -67.75 -34.85 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -31.28 66.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.23 -55.73 27.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.96 -26.27 66.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.85 39.08 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.497 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' GLY . . . . . 0.43 ' HA2' HD23 ' A' ' 189' ' ' LEU . . . -52.08 -33.89 38.21 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.53 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.06 -23.83 38.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -32.53 67.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.43 HD23 ' HA2' ' A' ' 186' ' ' GLY . 1.4 pp -63.14 -36.92 85.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.54 -49.53 32.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.13 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -44.89 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.856 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -60.4 -46.82 88.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.887 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -49.23 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.898 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.89 -31.69 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.46 -49.31 16.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.68 78.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.129 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.9 m -66.32 -47.61 72.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -69.9 -36.24 75.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.44 84.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.872 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 mp -71.23 -30.13 65.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 -51.33 69.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.836 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.66 -50.37 51.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.133 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.97 -54.92 32.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 43.2 m -54.62 -35.66 63.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.827 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.56 -48.35 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.09 -27.8 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.24 -22.01 64.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.501 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 9.9 mmtt -61.21 -63.07 4.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.567 0.699 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 54.6 Cg_endo -69.69 -26.92 27.43 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.717 2.278 . . . . 0.0 112.354 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.71 -32.88 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -36.65 73.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -54.32 -50.62 66.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.48 -30.49 63.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.14 -48.41 78.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 215' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 219' ' ' LEU . 0.9 OUTLIER -70.39 -41.97 72.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.7 -25.76 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.955 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.558 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -79.04 -44.49 9.8 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.73 -27.54 68.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.501 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 2.7 mp -50.85 -62.97 2.18 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 0.0 110.892 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.0 Cg_endo -69.69 -44.63 2.01 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.755 2.304 . . . . 0.0 112.328 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 217' ' ' GLY . 90.5 t -55.88 -54.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.133 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.85 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -66.37 -40.12 89.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -48.06 83.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.872 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.91 -38.06 82.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 223' ' ' GLU . 54.7 t -56.78 -49.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.145 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -50.75 72.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.832 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.38 -37.98 82.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.2 -40.59 97.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.28 72.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.91 -44.93 68.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.697 HD23 ' N ' ' A' ' 234' ' ' GLU . 0.0 OUTLIER -61.27 -38.99 88.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 234' ' ' GLU . . . . . 0.697 ' N ' HD23 ' A' ' 233' ' ' LEU . 0.7 OUTLIER -74.6 -35.4 62.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -68.05 -48.87 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -63.74 -41.01 98.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.97 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 237' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 233' ' ' LEU . 37.9 p -70.75 -45.88 63.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.078 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -56.22 -55.07 37.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.83 79.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 30.8 mt -57.77 -37.72 74.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.43 -30.36 69.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.3 m 73.08 -68.45 0.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.146 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.904 179.98 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.956 0.407 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 15.4 p -134.11 89.43 2.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -167.27 -43.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.9 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 6.7 p -64.57 -37.23 86.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.862 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -70.79 -46.27 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.72 -35.67 79.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -47.9 66.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.59 -34.1 71.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.868 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -75.06 -29.89 60.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.925 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.491 HD13 ' C ' ' B' ' 64' ' ' LEU . 3.1 tm? -53.34 -45.87 69.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 172.34 157.4 14.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.477 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -90.25 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.649 2.233 . . . . 0.0 112.359 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -58.82 -33.22 48.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.161 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 1.4 m -59.39 -39.75 84.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.171 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -64.53 -51.86 60.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.923 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.93 -29.75 71.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.934 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -66.23 -67.01 0.48 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.899 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -32.41 68.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.95 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -71.58 -48.49 47.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.817 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -57.47 -50.0 74.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -57.01 10.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.06 -33.73 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.885 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.75 -52.85 54.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -27.8 65.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -58.6 -26.84 64.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -51.02 -47.67 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -29.26 18.86 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.528 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.559 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.1 tm? -49.95 -42.98 49.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -58.15 -49.47 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -44.77 88.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.908 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.21 -50.14 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.26 -42.28 81.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.856 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.88 -50.41 74.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -43.64 90.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.704 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.88 -48.87 77.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 39.1 tp -57.04 -49.49 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.955 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -54.31 -47.83 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -36.11 82.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 89' ' ' ASP . 69.6 t -65.41 -32.7 59.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.099 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -75.09 -52.96 9.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.14 73.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -78.26 -33.83 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.58 -47.53 78.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.139 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.558 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.4 OUTLIER -42.61 -66.23 0.45 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.619 0.723 . . . . 0.0 110.942 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.2 Cg_endo -69.77 -29.6 23.58 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.695 2.264 . . . . 0.0 112.303 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' TYR . . . . . 0.435 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.5 t80 -58.0 -26.15 62.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.89 -49.43 17.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.932 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.15 -33.55 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.86 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -47.56 63.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -55.83 -52.94 62.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.887 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -47.28 79.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -60.37 -22.33 63.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -74.11 -48.47 29.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.871 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -31.92 73.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.6 -55.45 20.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.96 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -70.7 -34.57 72.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -69.79 -33.0 71.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 20.5 ttp -69.65 -54.4 14.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.64 -35.76 82.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -76.29 -25.98 55.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.738 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.7 t80 -62.92 -55.19 28.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -33.86 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.449 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 2.3 tt0 -69.37 -23.33 63.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -87.47 -44.99 10.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 115' ' ' TYR . 58.9 t -59.9 -32.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.122 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.545 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mm-40 -57.16 -65.35 1.78 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.3 Cg_endo -69.86 -51.4 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.66 2.24 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -65.89 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.942 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.32 -34.17 1.53 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.504 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tp10 -77.14 -47.01 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 110.877 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.32 -47.69 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -51.46 63.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -60.04 -44.13 94.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.21 -52.22 50.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.95 -33.33 73.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.429 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.36 -46.42 83.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 9.7 ttp180 -58.9 -52.71 64.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.51 -54.88 42.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -57.9 -42.6 85.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.6 t -61.08 -51.47 72.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.27 -50.87 28.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.32 -44.65 87.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.093 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -57.93 -41.61 83.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 -67.89 -45.4 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 23.8 m -55.94 -41.23 74.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -81.54 -33.98 31.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.833 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.67 -23.38 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.822 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -55.52 -62.42 4.51 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.546 0.689 . . . . 0.0 111.123 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.822 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.3 Cg_endo -69.77 -41.29 4.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.679 2.253 . . . . 0.0 112.38 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -62.56 -29.34 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 7.7 t -59.62 -51.47 69.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.79 -49.11 69.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.95 -51.57 68.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' B' ' 170' ' ' LEU . 2.4 tm? -60.98 -46.68 89.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -42.62 81.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -34.65 78.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -48.8 63.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.875 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -50.59 40.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.947 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 175' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.22 -35.23 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.091 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.33 -34.31 55.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.103 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -48.28 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.904 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.509 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.6 pp -68.99 -48.86 62.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.937 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 179' ' ' GLU . . . . . 0.509 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.2 OUTLIER -58.72 -50.51 73.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.08 89.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 52.5 tp -67.68 -34.84 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -31.77 66.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -55.12 -55.59 29.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.77 -26.21 66.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.4 -33.67 40.19 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 186' ' ' GLY . . . . . 0.434 ' HA2' HD23 ' B' ' 189' ' ' LEU . . . -52.01 -34.08 38.03 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.465 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.04 -23.79 38.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.733 0.301 . . . . 0.0 111.097 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -32.52 67.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.434 HD23 ' HA2' ' B' ' 186' ' ' GLY . 1.4 pp -63.08 -37.01 85.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.51 -49.57 31.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.053 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -44.59 90.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.62 -46.96 88.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.43 -49.22 67.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.61 70.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.078 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.49 -49.24 17.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.4 -34.89 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.1 m -65.95 -47.64 73.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.173 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -69.94 -36.23 75.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.885 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.37 84.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.33 -30.07 65.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.83 -51.24 69.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.856 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.75 -50.25 52.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.163 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.17 -54.94 32.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.869 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 43.3 m -54.53 -35.71 63.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.57 -48.31 81.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.07 -27.87 48.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.97 64.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.075 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 9.8 mmtt -61.28 -63.13 4.67 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.597 0.713 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.8 Cg_endo -69.82 -26.7 27.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.03 57.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.34 -36.48 74.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -54.34 -50.31 67.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -30.54 63.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.17 -48.32 79.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 215' ' ' ARG . . . . . 0.47 ' O ' HD13 ' B' ' 219' ' ' LEU . 0.9 OUTLIER -70.42 -42.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.81 -25.59 68.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.54 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -79.03 -44.62 9.68 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.456 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.64 -27.54 69.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.816 0.341 . . . . 0.0 110.93 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 2.6 mp -50.86 -62.92 2.23 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.593 0.711 . . . . 0.0 110.902 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.2 Cg_endo -69.81 -44.51 2.0 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.672 2.248 . . . . 0.0 112.323 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 217' ' ' GLY . 90.3 t -55.94 -54.19 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.132 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.88 71.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.915 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.746 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.5 mt-10 -66.33 -40.08 89.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -48.05 83.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.847 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -40.19 93.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 226' ' ' LYS . . . . . 0.404 ' O ' HD23 ' B' ' 230' ' ' LEU . 0.5 OUTLIER -67.96 -38.07 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.746 HG23 ' O ' ' B' ' 223' ' ' GLU . 53.2 t -56.71 -49.09 79.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -50.75 72.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -60.42 -37.93 82.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.404 HD23 ' O ' ' B' ' 226' ' ' LYS . 1.6 mm? -63.24 -40.63 97.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.886 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -31.26 72.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.865 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.92 -44.98 68.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.678 HD23 ' N ' ' B' ' 234' ' ' GLU . 0.0 OUTLIER -61.2 -39.04 88.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 234' ' ' GLU . . . . . 0.678 ' N ' HD23 ' B' ' 233' ' ' LEU . 0.7 OUTLIER -74.59 -35.51 62.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.827 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.96 -48.86 64.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.913 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -63.75 -41.09 98.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 237' ' ' THR . . . . . 0.423 HG23 ' O ' ' B' ' 233' ' ' LEU . 38.0 p -70.69 -45.83 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.123 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -56.22 -55.06 37.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.81 79.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.74 -37.75 74.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.58 -30.23 68.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.906 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.3 m 73.14 -68.62 0.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.161 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.921 0.391 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.15 -179.79 6.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.152 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.7 p90 -159.94 39.19 0.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.59 -37.14 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.837 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -69.92 -43.59 71.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.914 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.08 -39.65 95.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -49.48 60.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.855 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -65.09 -36.45 84.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -77.74 -25.52 49.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.48 HD13 ' C ' ' A' ' 64' ' ' LEU . 2.4 tm? -53.6 -43.52 68.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 126.35 79.26 0.31 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.484 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -47.12 1.0 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.696 2.264 . . . . 0.0 112.336 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.5 m -55.28 -38.01 46.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.2 m -71.83 -56.94 4.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.64 -34.96 69.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -70.01 -43.76 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.909 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -49.41 77.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.864 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -36.43 78.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.933 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -66.83 -52.45 43.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.828 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.6 -56.43 22.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.58 -34.45 74.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.929 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -56.48 -51.61 67.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -72.14 -32.12 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 82' ' ' LEU . 95.6 m -65.86 -23.69 66.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.135 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.409 ' O ' HD23 ' A' ' 82' ' ' LEU . 5.9 tt0 -50.04 -32.01 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.89 -27.85 14.84 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.592 HD23 ' H ' ' A' ' 83' ' ' ARG . 1.1 pt? -49.15 -34.71 14.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.79 0.329 . . . . 0.0 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.592 ' H ' HD23 ' A' ' 82' ' ' LEU . 3.4 ttm-85 -61.81 -49.88 74.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.12 -43.79 95.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.69 -49.69 74.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.18 -41.55 84.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.918 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -50.1 74.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.881 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.72 -44.29 90.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.24 -47.7 77.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.859 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 37.1 tp -57.39 -50.29 73.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.872 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -47.87 69.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.881 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -64.12 -34.86 79.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 74.4 t -65.54 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -74.71 -52.88 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.833 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.72 -33.11 73.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.119 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -77.37 -33.25 55.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.48 -43.93 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.143 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -43.87 -65.03 0.64 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.586 0.708 . . . . 0.0 110.897 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.75 -31.29 20.84 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.669 2.246 . . . . 0.0 112.375 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.409 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.6 t80 -58.18 -25.54 61.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.19 -50.17 35.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.95 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -64.36 -34.87 79.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.91 -52.39 65.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -64.49 -43.89 92.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -64.38 -22.89 67.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -49.42 34.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' TRP . . . . . 0.401 ' CD1' ' HD2' ' B' ' 149' ' ' ARG . 0.5 OUTLIER -65.13 -29.06 69.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -56.86 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.878 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -70.99 -34.43 71.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.892 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.01 -34.3 75.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -68.89 -54.03 17.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.82 -35.58 81.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.866 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.62 -26.65 55.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -62.13 -55.24 30.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.945 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -34.01 61.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.86 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 48.2 tt0 -68.17 -23.83 64.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmtt -86.73 -44.33 11.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 55.6 t -59.0 -32.65 48.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.1 mt-10 -56.91 -65.62 1.61 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.666 0.746 . . . . 0.0 110.896 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.1 Cg_endo -69.79 -52.19 0.34 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 0.0 112.302 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.66 -64.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.19 -32.39 2.51 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.514 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -44.85 34.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.868 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -68.06 -41.91 81.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -46.25 74.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.894 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.427 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.5 tpp180 -66.49 -41.59 88.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.73 -52.86 18.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -59.54 -39.87 85.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.77 -41.15 99.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.139 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -52.63 64.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.21 45.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.123 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -56.29 -45.32 80.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.72 -52.17 64.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.088 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.03 -52.35 15.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.881 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.2 93.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.103 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.01 -44.23 87.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.3 -44.59 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 24.3 m -55.58 -42.11 74.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.125 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -81.86 -32.61 31.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.799 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -69.98 -24.51 63.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.929 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.842 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.38 -62.94 3.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.842 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.4 Cg_endo -69.78 -43.36 2.69 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.692 2.261 . . . . 0.0 112.348 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' TYR . . . . . 0.674 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.9 t80 -58.4 -33.4 69.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.876 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -52.11 64.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -67.06 -31.95 72.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.881 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -66.79 -51.15 59.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.674 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -58.46 -49.76 76.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -36.31 72.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.853 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.82 -52.63 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.53 -47.74 77.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.84 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.1 -51.43 69.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.61 -35.79 63.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.083 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.27 50.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.066 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -48.32 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.868 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.7 pp -67.42 -49.71 62.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' A' ' 178' ' ' LEU . 2.2 pp20? -59.71 -34.09 72.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.27 -45.3 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.081 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.57 -40.97 76.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -75.61 -32.2 60.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -56.82 15.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.844 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.75 -26.33 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.905 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.29 -34.39 40.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.53 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.67 38.77 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.1 39.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.78 0.324 . . . . 0.0 111.08 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -73.56 -32.49 64.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.872 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -37.91 89.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.2 -49.92 31.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.087 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -63.87 -42.1 97.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.1 -45.27 92.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -54.47 -47.9 72.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.829 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.65 72.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -76.04 -50.6 14.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.34 93.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.119 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' THR . . . . . 0.547 HG21 HD13 ' B' ' 240' ' ' LEU . 83.6 m -61.43 -47.48 85.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -36.51 83.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.853 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.57 -44.66 89.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.842 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -71.85 -30.09 65.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.6 m -57.44 -51.37 69.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -51.06 50.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.197 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.33 -54.84 34.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 50.7 m -54.53 -35.23 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.09 -47.8 83.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -77.71 -30.28 51.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 207' ' ' ALA . . . . . 0.479 ' O ' HD23 ' A' ' 211' ' ' LEU . . . -68.22 -22.13 64.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.126 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.514 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -59.14 -63.37 4.26 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 110.904 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.514 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.75 -24.73 29.4 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.722 2.282 . . . . 0.0 112.348 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.2 -32.5 59.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.092 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.506 HD13 HD22 ' A' ' 214' ' ' LEU . 1.9 mm? -73.12 -35.88 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -53.85 -51.6 63.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.15 -30.85 58.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.506 HD22 HD13 ' A' ' 211' ' ' LEU . 2.9 tt -61.89 -51.26 68.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.949 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.48 -37.13 84.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -56.74 -48.87 76.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.877 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.53 -29.53 74.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.478 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.24 -32.96 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.348 . . . . 0.0 110.921 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -49.81 -61.14 3.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.644 0.735 . . . . 0.0 110.912 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.76 -39.61 6.31 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.663 2.242 . . . . 0.0 112.363 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.8 t -58.0 -54.73 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.21 74.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.679 ' O ' HG23 ' A' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.34 80.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 14.1 m -59.88 -48.19 82.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -43.1 94.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 223' ' ' GLU . 51.6 t -55.76 -43.56 74.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.2 -50.45 73.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -61.09 -38.98 88.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.793 HD22 HD11 ' A' ' 233' ' ' LEU . 3.0 tm? -62.19 -33.39 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -31.43 67.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.795 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.44 -53.05 39.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.119 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 230' ' ' LEU . 0.8 OUTLIER -66.18 -43.3 87.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.941 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.3 -34.65 78.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.55 -49.34 75.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.23 -45.83 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.907 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.36 -45.95 88.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.15 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.11 -53.89 50.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -45.88 77.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.502 HD13 HG21 ' B' ' 197' ' ' THR . 13.1 tp -56.91 -37.42 71.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 73.29 -68.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.842 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 76.19 -55.62 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.939 0.399 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.43 -179.54 6.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -159.98 39.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.0 -37.3 86.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.878 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm -69.88 -43.5 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.23 -39.54 94.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -49.51 59.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.05 -36.39 84.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -77.87 -25.39 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.497 HD13 ' C ' ' B' ' 64' ' ' LEU . 2.4 tm? -53.74 -43.47 69.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 126.42 79.16 0.31 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.502 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -47.23 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.666 2.244 . . . . 0.0 112.346 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -55.11 -37.94 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.129 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 22.0 m -71.86 -57.2 4.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.129 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.909 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -70.1 -43.96 70.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -49.32 78.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -36.43 78.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.66 -52.19 47.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.835 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -61.02 -46.51 90.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.45 -56.4 22.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.8 -34.31 74.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -56.41 -51.54 67.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -72.23 -32.33 66.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' B' ' 82' ' ' LEU . 95.5 m -65.58 -23.54 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.153 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.22 -32.14 15.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -27.98 14.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.435 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.594 HD23 ' H ' ' B' ' 83' ' ' ARG . 1.1 pt? -49.09 -34.61 14.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.314 . . . . 0.0 110.892 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ARG . . . . . 0.594 ' H ' HD23 ' B' ' 82' ' ' LEU . 3.5 ttm-85 -61.85 -49.96 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.854 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.16 -43.75 95.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.67 -49.62 74.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.41 -41.34 84.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.75 -44.37 90.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.714 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.1 -47.91 77.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.54 -49.88 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.924 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.46 -47.58 69.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -64.52 -34.93 79.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 89' ' ' ASP . 71.0 t -65.52 -32.9 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.129 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -75.36 -53.3 8.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.78 74.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.117 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -77.45 -33.43 54.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -55.31 -47.75 77.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.14 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.565 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -42.28 -66.49 0.41 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.609 0.719 . . . . 0.0 110.91 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.565 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.74 -30.45 22.37 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.8 t80 -57.5 -25.04 59.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.907 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.42 -49.4 19.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -59.68 -34.7 73.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.874 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -47.49 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -55.99 -52.57 63.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.46 -44.62 90.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -62.71 -22.5 66.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -50.28 22.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.906 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.42 -30.58 71.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -56.44 13.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.42 -34.88 73.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -69.14 -32.52 71.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.913 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' MET . . . . . 0.427 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 2.7 tmm? -69.8 -54.01 15.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.893 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -65.6 -35.43 80.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.18 -26.63 56.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.74 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.4 t80 -62.51 -55.07 30.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.957 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -33.36 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 48.8 tt0 -69.12 -22.78 63.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -88.39 -46.39 9.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.74 HG23 ' O ' ' B' ' 115' ' ' TYR . 56.4 t -58.72 -32.59 46.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.135 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 1.0 OUTLIER -57.5 -65.53 1.74 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.616 0.722 . . . . 0.0 110.871 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.69 -51.66 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.685 2.257 . . . . 0.0 112.338 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -65.37 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.78 -32.0 2.03 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.27 -46.79 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.43 -46.34 73.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -51.96 61.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.401 ' HD2' ' CD1' ' A' ' 108' ' ' TRP . 12.9 tpp180 -60.32 -43.14 96.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.883 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.49 -52.01 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -59.97 -34.07 72.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.406 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.51 -45.27 87.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.115 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.852 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.25 -54.94 39.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.075 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -56.76 -43.87 81.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.862 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.8 t -60.21 -51.34 74.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.48 -51.49 20.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.8 90.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.115 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.08 -42.24 85.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.912 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.55 -45.63 75.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 24.2 m -55.61 -41.52 73.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.145 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -81.51 -32.89 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.25 -24.6 63.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.833 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.23 -62.75 3.46 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.605 0.717 . . . . 0.0 111.089 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.833 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.7 Cg_endo -69.75 -42.37 3.47 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 0.0 112.346 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 166' ' ' TYR . . . . . 0.66 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.3 t80 -59.57 -33.68 71.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.43 -52.0 65.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -66.76 -32.34 73.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.8 -51.0 60.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.66 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.49 -49.57 76.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -36.13 72.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -52.43 62.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.891 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.16 -47.72 78.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.861 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.41 -51.22 70.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.903 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' ALA . . . . . 0.527 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -54.82 -35.45 63.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.12 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.34 50.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -47.94 60.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.8 pp -67.85 -49.55 61.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' B' ' 178' ' ' LEU . 2.1 pp20? -59.57 -34.21 72.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.31 -45.39 47.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.068 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.84 -40.93 76.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -75.64 -32.85 60.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.899 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -56.53 18.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.67 -26.31 60.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.855 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.45 -34.22 41.67 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.457 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.13 -33.71 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.529 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.11 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -73.54 -32.74 64.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -38.15 90.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.15 -49.71 33.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.124 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.97 -41.83 97.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.29 -45.46 91.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.33 -47.75 72.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.881 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.35 -31.55 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.084 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -76.03 -50.52 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.63 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.126 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 197' ' ' THR . . . . . 0.502 HG21 HD13 ' A' ' 240' ' ' LEU . 80.9 m -61.27 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.166 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -36.51 83.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.6 -44.55 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.01 -30.13 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 9.2 m -57.45 -51.24 70.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.835 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -51.02 50.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.137 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.44 -54.84 35.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.875 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 50.3 m -54.69 -35.09 63.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.1 -47.77 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -77.81 -30.4 51.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.883 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' ALA . . . . . 0.483 ' O ' HD23 ' B' ' 211' ' ' LEU . . . -68.19 -22.1 64.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.127 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.519 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -59.15 -63.48 4.12 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.556 0.693 . . . . 0.0 110.911 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.9 Cg_endo -69.81 -24.71 29.12 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.332 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.29 -32.29 58.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.498 HD13 HD22 ' B' ' 214' ' ' LEU . 1.8 mm? -73.19 -35.78 66.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -53.78 -51.45 63.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.914 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.16 -30.78 58.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.498 HD22 HD13 ' B' ' 211' ' ' LEU . 2.9 tt -61.95 -51.36 68.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.35 -37.12 84.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -56.76 -48.8 77.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.554 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.55 -29.41 73.98 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.5 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.27 -32.98 74.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.897 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.0 OUTLIER -49.79 -61.13 3.91 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.62 0.724 . . . . 0.0 110.931 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.73 -39.71 6.24 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.707 2.271 . . . . 0.0 112.349 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.06 -54.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.113 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.17 74.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.681 ' O ' HG23 ' B' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.37 80.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 14.0 m -59.86 -48.18 82.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.3 -41.94 96.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -43.15 94.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 223' ' ' GLU . 51.4 t -55.68 -43.49 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.152 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.34 -50.33 74.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -61.13 -39.01 88.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.854 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.755 HD22 HD11 ' B' ' 233' ' ' LEU . 3.0 tm? -62.18 -33.4 74.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.57 -31.34 66.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.06 39.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.143 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.755 HD11 HD22 ' B' ' 230' ' ' LEU . 0.8 OUTLIER -66.13 -43.23 87.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.917 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.34 -34.62 78.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.65 -49.25 75.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.18 -45.96 86.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.953 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.27 -45.97 88.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.119 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.17 -53.84 50.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -45.91 77.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.547 HD13 HG21 ' A' ' 197' ' ' THR . 13.1 tp -56.77 -37.52 71.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.922 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 73.25 -68.67 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.16 -55.58 0.59 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.135 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.1 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.966 0.412 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.28 148.18 4.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.145 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -142.87 38.71 1.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.869 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -75.02 -43.47 53.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.905 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -34.98 70.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.2 mp -69.94 -43.34 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -71.7 -34.5 69.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.31 -49.96 15.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -64.68 -22.86 67.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.593 HD21 ' HG2' ' A' ' 70' ' ' GLU . 0.2 OUTLIER -49.99 -18.28 0.51 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.919 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.561 ' C ' ' O ' ' A' ' 64' ' ' LEU . . . -21.99 -86.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.513 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 172.91 11.75 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.759 2.306 . . . . 0.0 112.342 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.537 HG23 ' N ' ' A' ' 68' ' ' THR . 21.1 m -75.8 -49.72 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.537 ' N ' HG23 ' A' ' 67' ' ' VAL . 11.9 m -51.2 -27.82 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.181 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.41 -45.76 65.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.593 ' HG2' HD21 ' A' ' 64' ' ' LEU . 11.9 tm-20 -62.5 -42.33 99.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -63.72 -59.86 4.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.897 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -27.53 65.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.5 -52.79 35.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.87 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.19 -34.94 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -45.51 64.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.55 65.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.58 -32.04 65.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.14 -48.53 78.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.37 -45.48 31.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.124 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.57 -30.84 67.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.931 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.42 56.09 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.452 HD11 HD21 ' B' ' 178' ' ' LEU . 8.7 mt -58.89 -35.8 73.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -49.62 77.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -68.6 -48.21 64.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.12 -29.19 69.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.855 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.56 -51.81 13.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.0 p -65.66 -35.88 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -40.63 64.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -61.96 -48.09 81.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.67 -50.94 55.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -58.01 -42.47 85.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.89 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.45 -47.94 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.898 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 97' ' ' VAL . 4.4 t -56.72 -33.16 39.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.114 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -52.32 10.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.87 -35.61 77.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -79.27 -34.92 42.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.429 ' HA ' ' HB2' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -53.51 -44.77 57.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.112 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.56 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -47.67 -65.96 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.58 0.705 . . . . 0.0 110.92 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.56 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.6 Cg_endo -69.71 -24.87 29.42 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.668 2.245 . . . . 0.0 112.347 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.429 ' HB2' ' HA ' ' A' ' 97' ' ' VAL . 2.7 m-30 -61.35 -35.08 76.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -51.66 16.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.943 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.05 -34.27 77.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.62 -47.32 76.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.41 -52.05 67.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -64.73 -47.52 77.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -63.99 -22.68 67.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.908 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -71.11 -48.52 51.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -23.31 57.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -64.99 -60.02 3.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.66 -34.32 73.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.42 -30.51 69.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -71.8 -53.28 13.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.87 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.29 -35.02 79.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 114' ' ' LEU . 3.1 tm? -76.35 -26.19 55.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.71 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.2 t80 -65.65 -54.76 23.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.951 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.87 -33.9 66.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.417 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 22.1 tt0 -70.19 -23.09 62.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -90.3 -45.22 9.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 115' ' ' TYR . 94.5 t -59.98 -32.45 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.139 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.539 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -57.88 -64.68 2.45 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.637 0.732 . . . . 0.0 110.901 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.4 Cg_endo -69.8 -50.94 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.679 2.253 . . . . 0.0 112.32 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -63.54 1.04 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.5 -30.47 4.49 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.496 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.52 -43.32 56.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.328 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.19 -33.96 63.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 2.6 ttt -66.99 -48.94 66.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -38.26 86.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.872 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -71.57 -52.58 17.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.8 mmt-85 -63.0 -38.2 90.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.28 -37.69 88.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -64.04 -49.89 70.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.6 -38.67 70.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.043 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -66.9 -50.74 61.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 152' ' ' ALA . 4.8 p -64.32 -40.62 89.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.418 ' N ' ' CG1' ' A' ' 156' ' ' VAL . 22.4 t0 -52.61 -50.56 62.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.833 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.48 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.099 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.96 -38.73 73.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -68.51 -45.57 71.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.839 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 34.7 m -55.4 -40.98 72.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.77 -34.04 30.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.02 -21.47 62.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -56.44 -62.66 4.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.61 0.719 . . . . 0.0 111.098 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.9 Cg_endo -69.74 -42.23 3.61 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.335 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' TYR . . . . . 0.412 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.5 t80 -55.76 -33.68 64.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -51.58 69.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.834 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.73 -32.69 73.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.864 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -50.05 72.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.412 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -59.21 -49.59 77.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.69 -37.74 76.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.62 -51.79 68.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.44 -38.69 81.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -41.92 75.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -45.45 75.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.25 -34.57 70.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.078 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.86 -37.5 87.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.603 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -68.09 -51.6 44.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.89 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.603 ' N ' HD23 ' A' ' 178' ' ' LEU . 10.2 pt-20 -65.93 -40.64 91.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.77 -46.48 77.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -35.88 79.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.898 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -31.84 69.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.888 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -56.15 21.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.865 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.8 -25.76 63.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.53 -31.72 44.67 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.511 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -64.02 -49.88 64.35 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.46 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.68 -21.83 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.322 . . . . 0.0 111.127 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -71.76 -29.11 64.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -49.91 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.914 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.45 -48.95 68.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.115 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -63.37 -51.45 65.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.903 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -54.11 -48.93 70.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.91 69.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.68 -42.4 41.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.922 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.94 -47.7 73.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.137 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 40.0 p -60.07 -46.82 88.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.187 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.88 -35.86 75.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.12 -54.27 46.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -28.7 64.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.53 -51.41 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.817 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -50.85 30.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.71 -57.34 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -54.46 -35.96 63.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.99 -47.84 81.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -27.75 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.31 66.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.524 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.0 OUTLIER -64.61 -63.99 3.17 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.581 0.705 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.524 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.4 Cg_endo -69.77 -26.85 27.13 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.724 2.283 . . . . 0.0 112.298 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.73 -31.75 59.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 5.7 tt -71.2 -40.83 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.65 -51.16 66.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -75.99 -29.81 58.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.851 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -45.78 91.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 215' ' ' ARG . . . . . 0.652 ' O ' HD13 ' A' ' 219' ' ' LEU . 8.4 mtp180 -72.92 -40.03 65.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -68.06 -25.12 65.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -80.7 -49.84 5.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -27.99 69.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.846 0.355 . . . . 0.0 110.925 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.652 HD13 ' O ' ' A' ' 215' ' ' ARG . 1.4 mp -50.51 -63.43 1.85 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.596 0.712 . . . . 0.0 110.948 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.2 Cg_endo -69.74 -46.44 1.23 Allowed 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.709 2.272 . . . . 0.0 112.363 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 217' ' ' GLY . 94.0 t -54.59 -55.09 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.187 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.06 -31.71 70.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.937 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 227' ' ' VAL . 22.1 tt0 -69.11 -36.28 77.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.58 83.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.22 -44.22 97.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -40.25 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 223' ' ' GLU . 38.9 t -55.38 -48.39 76.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.102 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 2.3 t -59.02 -50.11 75.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.831 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.09 -35.22 79.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.859 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 230' ' ' LEU . 0.3 OUTLIER -64.09 -34.24 77.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.908 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 67.4 m -73.56 -31.4 63.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.55 57.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.113 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.514 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.7 pp -64.9 -37.93 89.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.5 -34.97 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.36 -49.9 57.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -58.93 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.905 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 35.1 m -67.88 -39.81 83.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.145 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.63 -54.17 49.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -48.99 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.945 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.06 -33.47 69.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.96 -22.07 31.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.63 -68.79 0.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.92 179.971 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.924 0.392 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.45 148.12 4.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.11 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -142.8 38.87 1.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.88 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -75.11 -43.49 52.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.894 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.58 -34.94 70.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.885 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 8.2 mp -69.86 -43.46 71.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.937 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -71.67 -34.44 69.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -76.35 -49.99 15.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.86 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -64.71 -22.97 67.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.572 HD21 ' HG2' ' B' ' 70' ' ' GLU . 0.2 OUTLIER -49.93 -18.32 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.898 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 65' ' ' GLY . . . . . 0.568 ' C ' ' O ' ' B' ' 64' ' ' LEU . . . -21.87 -86.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.487 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 172.96 11.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.691 2.261 . . . . 0.0 112.34 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' VAL . . . . . 0.543 HG23 ' N ' ' B' ' 68' ' ' THR . 21.3 m -75.78 -49.66 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.11 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' THR . . . . . 0.543 ' N ' HG23 ' B' ' 67' ' ' VAL . 11.9 m -51.3 -27.82 10.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.13 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -45.75 65.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.572 ' HG2' HD21 ' B' ' 64' ' ' LEU . 11.9 tm-20 -62.55 -42.24 99.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.8 -59.78 4.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -27.47 65.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.44 -52.84 34.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.857 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.16 -34.85 78.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.02 -45.42 63.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.0 -33.58 65.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.48 -32.13 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.1 -48.56 78.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -45.49 31.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.118 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.55 -30.98 67.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.878 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.38 -33.49 56.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.441 HD11 HD21 ' A' ' 178' ' ' LEU . 8.6 mt -58.85 -35.78 73.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.794 0.331 . . . . 0.0 110.9 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -49.73 76.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -68.49 -48.0 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.34 -29.1 69.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.53 -51.6 14.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.912 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 19.1 p -65.93 -35.9 81.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.862 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -40.61 64.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.41 ' O ' HG23 ' B' ' 93' ' ' VAL . 12.2 m-20 -62.15 -48.58 79.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.3 -50.75 59.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -57.78 -42.79 84.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.88 -45.05 60.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.495 ' O ' HG23 ' B' ' 97' ' ' VAL . 4.0 t -59.59 -33.93 53.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.134 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -53.91 7.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.87 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.124 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.8 tptt -79.14 -35.89 41.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.898 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 93' ' ' VAL . 0.9 OUTLIER -50.69 -47.64 28.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.113 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.595 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -45.73 -68.07 0.33 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.576 0.703 . . . . 0.0 110.941 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.4 Cg_endo -69.74 -18.11 37.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.696 2.264 . . . . 0.0 112.35 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -66.18 -34.36 77.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.96 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -50.81 11.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.49 -35.52 74.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.93 -46.84 73.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -52.24 66.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.44 -47.93 74.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -62.52 -22.51 66.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -72.31 -48.42 42.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -24.98 59.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.888 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.17 -60.8 2.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.47 -34.59 77.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -69.19 -30.43 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.885 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -70.37 -53.67 15.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -66.68 -35.03 79.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.586 HD13 ' O ' ' B' ' 114' ' ' LEU . 3.1 tm? -76.06 -26.21 56.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.888 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.704 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.3 t80 -65.56 -54.94 20.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -73.12 -33.56 65.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.427 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 22.6 tt0 -70.45 -22.56 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.927 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -91.13 -45.61 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 115' ' ' TYR . 91.8 t -60.26 -32.77 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.155 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -58.04 -64.54 2.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.644 0.735 . . . . 0.0 110.892 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.1 Cg_endo -69.76 -50.29 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.685 2.257 . . . . 0.0 112.319 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -64.09 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.876 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.43 3.74 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.493 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -75.37 -45.39 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.822 0.344 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.72 -35.93 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 1.8 ttt -66.66 -54.04 27.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.877 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -39.3 93.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -68.83 -52.68 27.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 7.4 mmt-85 -63.63 -32.26 73.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.482 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.31 -42.89 92.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.082 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -62.18 -46.54 88.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.22 69.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.08 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -66.76 -50.67 61.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.482 HG12 ' O ' ' B' ' 152' ' ' ALA . 9.8 p -63.49 -40.02 87.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.168 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' ASP . . . . . 0.415 ' N ' HG13 ' B' ' 156' ' ' VAL . 21.0 t0 -52.84 -50.32 63.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.73 -48.96 67.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.145 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.39 -38.07 73.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 20.7 tpp85 -68.61 -45.15 72.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 34.8 m -55.8 -40.83 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.94 -34.07 29.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.836 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.33 -21.63 62.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -56.15 -62.39 4.85 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 0.0 111.092 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.1 Cg_endo -69.71 -41.56 4.23 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.724 2.282 . . . . 0.0 112.367 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 166' ' ' TYR . . . . . 0.416 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.4 t80 -56.51 -34.22 66.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.955 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.15 -51.45 69.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.69 -32.91 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -50.06 71.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.416 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.9 -37.96 77.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -51.66 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.937 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -39.34 81.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.867 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -41.59 77.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.15 75.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.87 71.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.77 -36.97 86.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.817 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 178' ' ' LEU . . . . . 0.589 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.3 tt -68.59 -51.37 43.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.897 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 179' ' ' GLU . . . . . 0.589 ' N ' HD23 ' B' ' 178' ' ' LEU . 10.0 pt-20 -65.45 -42.19 92.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.945 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.19 77.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.084 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -35.35 77.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -31.51 70.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.952 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -55.85 24.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.81 -25.82 63.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.54 -31.97 45.17 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.464 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -63.83 -49.9 64.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.495 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.86 -21.65 43.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.071 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -71.89 -29.11 64.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -49.9 75.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.39 -49.02 68.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.114 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.22 -34.2 76.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.867 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.2 -51.56 65.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.917 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -54.02 -48.8 70.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.835 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.82 69.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.123 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.73 -42.34 41.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.71 73.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 39.9 p -60.12 -46.82 88.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.084 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.87 -35.83 75.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.21 -54.32 45.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.821 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.07 -28.71 64.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.54 -51.27 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.81 30.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.117 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.84 -57.28 11.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.5 m -54.43 -35.98 63.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.97 -47.81 81.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.81 -27.78 44.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.46 -23.35 66.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.151 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.523 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.0 OUTLIER -64.47 -64.01 3.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.574 0.702 . . . . 0.0 110.923 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -26.89 27.36 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 0.0 112.331 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.68 -31.69 59.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.099 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 5.6 tt -71.13 -40.97 71.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.57 -51.12 66.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.903 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.94 -29.87 58.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.02 -45.69 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.91 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 215' ' ' ARG . . . . . 0.64 ' O ' HD13 ' B' ' 219' ' ' LEU . 8.6 mtp180 -73.01 -39.83 65.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.23 -25.07 65.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.547 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -80.69 -49.94 5.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.472 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -28.01 69.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.866 0.365 . . . . 0.0 110.896 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.64 HD13 ' O ' ' B' ' 215' ' ' ARG . 1.4 mp -50.45 -63.44 1.84 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.615 0.721 . . . . 0.0 110.921 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.82 -46.51 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.662 2.242 . . . . 0.0 112.338 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.547 HG23 ' O ' ' B' ' 217' ' ' GLY . 91.9 t -54.56 -55.08 17.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.124 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.08 -31.79 70.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.896 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.702 ' O ' HG23 ' B' ' 227' ' ' VAL . 22.0 tt0 -69.1 -36.17 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -47.65 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.24 -44.18 97.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.864 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -40.33 95.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.702 HG23 ' O ' ' B' ' 223' ' ' GLU . 38.6 t -55.39 -48.34 77.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.085 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 2.2 t -59.07 -50.06 75.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -35.33 79.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.541 HD13 ' O ' ' B' ' 230' ' ' LEU . 0.3 OUTLIER -64.1 -34.14 77.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 67.3 m -73.62 -31.41 63.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.57 56.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.077 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.7 pp -64.92 -37.95 89.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.41 -34.93 68.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.92 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.38 -50.01 56.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -58.87 -47.1 86.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.3 m -67.9 -39.86 83.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.61 -54.18 48.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -48.98 77.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 58.9 tp -58.08 -33.52 69.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.889 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.83 -22.14 31.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.873 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.64 -68.77 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.908 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.941 0.4 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -148.12 172.31 14.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.106 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -90.67 47.79 1.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 t -64.34 -37.67 88.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.838 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.3 tptm -76.41 -46.47 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -38.68 91.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.931 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -45.32 62.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -42.46 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.848 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.521 ' O ' HG23 ' A' ' 68' ' ' THR . 9.1 pt20 -78.06 -22.33 49.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -38.88 69.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.959 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -52.19 177.43 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.463 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -4.79 14.73 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.288 . . . . 0.0 112.33 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 m -64.44 -28.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.148 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER -43.98 -33.74 1.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.154 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -58.23 -50.03 75.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -72.53 -27.54 62.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -62.91 -55.15 28.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -71.02 -34.78 71.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.939 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.31 -53.71 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 -65.21 -39.21 92.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.82 -54.91 39.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.58 -36.09 77.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -50.73 70.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.06 -31.44 61.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.662 HG23 HD23 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -59.01 -22.07 60.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.149 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.58 -34.18 17.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.84 -27.04 19.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.476 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.662 HD23 HG23 ' A' ' 79' ' ' THR . 2.0 pp -48.36 -35.65 12.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.789 0.328 . . . . 0.0 110.93 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -60.27 -50.21 74.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -45.08 96.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -49.06 73.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.13 -40.78 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -50.66 73.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.78 -46.27 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 22.2 t0 -55.6 -46.15 77.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -57.48 -50.24 73.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -48.58 69.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.21 -36.68 84.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 70.5 t -64.99 -32.03 56.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -73.92 -52.64 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.85 -33.66 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.103 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -77.89 -32.85 52.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.35 -43.59 86.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.178 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 mm-40 -43.59 -65.21 0.61 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.701 . . . . 0.0 110.866 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.74 -32.15 19.24 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.712 2.274 . . . . 0.0 112.306 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.404 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.2 t80 -58.58 -25.02 62.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.929 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.58 -51.07 25.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -33.0 74.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.872 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -47.54 68.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.825 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.91 -52.46 64.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -64.58 -47.27 79.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.914 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -60.31 -22.96 63.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -74.71 -46.87 34.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.942 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -29.79 70.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -68.64 -54.61 15.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.896 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -35.12 73.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.849 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -70.41 -30.48 67.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -71.43 -53.26 14.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.916 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.36 -35.03 79.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.8 tp -76.15 -26.12 55.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.706 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.1 t80 -66.48 -54.18 26.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.951 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -72.96 -34.05 66.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 43.1 tt0 -70.34 -23.79 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.93 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -89.04 -45.05 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.87 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 115' ' ' TYR . 99.5 t -61.33 -32.12 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.538 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.3 OUTLIER -56.22 -64.69 2.1 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.626 0.727 . . . . 0.0 110.845 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.5 Cg_endo -69.76 -52.02 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.693 2.262 . . . . 0.0 112.326 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -63.02 1.2 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.57 -32.38 2.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.458 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.31 -44.09 47.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.354 . . . . 0.0 110.927 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.56 -36.86 73.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -48.33 66.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.916 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -68.82 -37.75 79.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.2 -52.86 16.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -62.42 -41.37 98.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.64 -39.87 92.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.092 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -62.23 -53.12 59.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.12 61.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -60.58 -45.16 94.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.83 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.11 -53.72 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.37 -52.64 20.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.4 96.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.54 -41.89 86.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.941 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -65.54 -48.26 73.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 21.3 m -55.56 -42.46 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.129 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.88 -32.44 51.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.15 -19.63 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.8 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.68 -62.38 6.0 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.607 0.718 . . . . 0.0 111.121 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.8 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.1 Cg_endo -69.86 -47.12 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 0.0 112.327 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' TYR . . . . . 0.5 ' O ' HD13 ' A' ' 170' ' ' LEU . 19.7 m-30 -55.92 -27.44 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -51.35 64.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.846 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.32 -34.51 78.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -51.96 21.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.932 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 166' ' ' TYR . 8.8 mp -61.14 -49.45 77.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -61.22 -33.71 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -52.33 64.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.61 -43.1 69.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.97 -50.63 72.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.76 -32.81 74.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.25 -42.02 60.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.068 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -73.77 -32.09 63.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.69 -49.54 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.948 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.23 -35.59 71.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.02 -47.89 60.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.16 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.55 -43.32 93.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -32.43 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -51.03 68.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.92 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -69.08 -26.32 64.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.56 42.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.453 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.43 -31.9 36.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.462 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.47 -25.62 41.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -38.23 64.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -37.26 80.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.957 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.24 -48.78 40.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -47.99 81.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.29 -44.04 95.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.896 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.08 -47.44 71.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.861 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.49 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -76.07 -51.31 12.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.845 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.63 -45.66 78.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' THR . . . . . 0.507 HG21 HD13 ' B' ' 240' ' ' LEU . 95.3 m -59.59 -46.86 87.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.66 -38.65 91.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.59 -40.62 83.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.865 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -32.08 65.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.891 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 201' ' ' SER . . . . . 0.727 ' OG ' HG23 ' B' ' 237' ' ' THR . 0.5 OUTLIER -57.79 -50.99 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.854 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.29 -51.27 59.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.186 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.77 -50.23 68.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.82 -35.23 68.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.72 -47.81 84.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -31.75 56.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.34 63.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.085 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.5 OUTLIER -60.41 -63.12 4.66 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.601 0.715 . . . . 0.0 110.916 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.73 -27.65 26.37 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.68 2.254 . . . . 0.0 112.364 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.41 -31.82 58.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.29 -36.39 68.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.84 -50.91 65.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -73.68 -34.0 64.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.6 tt -61.46 -49.29 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.93 -36.1 83.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -57.03 -48.79 77.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.553 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.6 -29.52 74.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.438 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.19 -32.51 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.921 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.4 OUTLIER -49.42 -60.79 4.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.602 0.715 . . . . 0.0 110.947 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.82 -39.01 6.89 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.679 2.253 . . . . 0.0 112.333 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 217' ' ' GLY . 49.0 t -58.17 -55.33 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 -34.42 73.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.1 OUTLIER -66.58 -34.78 78.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -48.32 82.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.17 -42.5 79.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -63.08 -46.58 86.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 223' ' ' GLU . 40.1 t -56.89 -39.91 68.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.129 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 28.7 m -58.67 -50.26 74.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -61.25 -36.76 80.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.912 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.482 ' HA ' HD21 ' A' ' 233' ' ' LEU . 1.8 tp -63.71 -34.39 77.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -30.82 66.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.31 -51.37 53.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.111 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.0 OUTLIER -67.56 -44.79 77.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.867 -179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -35.81 79.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.13 -48.9 66.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -54.16 -40.72 67.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' OG ' ' B' ' 201' ' ' SER . 97.1 m -73.09 -40.23 65.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.54 -54.83 39.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -37.41 78.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.474 HD13 HG21 ' B' ' 197' ' ' THR . 2.3 tp -57.68 -38.16 74.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -172.99 87.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 1.5 m -51.39 128.83 23.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.148 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.888 -179.975 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.958 0.408 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 61.3 p -148.23 172.27 14.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -90.67 47.69 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.4 t -64.09 -37.7 88.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 tptm -76.4 -46.4 27.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -38.67 91.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.891 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -45.42 62.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.57 -42.42 92.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.904 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.521 ' O ' HG23 ' B' ' 68' ' ' THR . 9.1 pt20 -77.98 -22.41 49.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -39.0 69.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -52.17 177.48 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.491 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 -4.83 14.79 Favored 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.721 2.281 . . . . 0.0 112.367 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 m -64.36 -28.56 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' THR . . . . . 0.521 HG23 ' O ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -44.01 -33.68 1.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.138 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -58.21 -50.08 74.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.924 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -72.5 -27.66 62.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -62.79 -55.12 29.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -71.08 -34.68 71.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.26 -53.82 26.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -65.1 -39.36 93.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.65 -54.92 39.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.75 -35.97 77.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.46 -50.69 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.887 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.12 -31.4 61.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' THR . . . . . 0.653 HG23 HD23 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -58.92 -22.07 59.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.145 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.7 -34.25 18.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.89 -27.09 20.0 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.653 HD23 HG23 ' B' ' 79' ' ' THR . 2.0 pp -48.46 -35.58 13.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 0.0 110.903 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 64.6 ttt-85 -60.3 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -45.04 96.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.89 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.08 73.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.27 -40.62 86.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.94 -50.62 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.95 -46.43 88.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.699 ' O ' HG23 ' B' ' 93' ' ' VAL . 22.1 t0 -55.38 -46.4 76.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 60.6 mt -57.46 -50.1 74.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -48.62 69.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.41 -36.58 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.901 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 89' ' ' ASP . 73.6 t -65.12 -32.07 56.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.16 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -74.38 -53.07 10.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.921 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.0 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -78.22 -33.05 50.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.13 -46.79 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.568 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.6 mm-40 -42.75 -66.52 0.42 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.663 0.744 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.568 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.78 -31.54 20.24 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.698 2.265 . . . . 0.0 112.305 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' TYR . . . . . 0.443 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 12.7 t80 -58.17 -24.19 58.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.52 -50.02 16.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.914 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -33.04 70.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.86 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -46.76 65.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -53.42 56.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -63.51 -47.72 80.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.937 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -61.06 -22.21 64.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -72.74 -48.08 41.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -63.4 -31.41 72.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.8 -55.82 20.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.1 -34.44 71.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.39 -32.75 70.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -53.45 18.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.4 -35.84 82.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.908 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -76.22 -25.96 55.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.877 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.696 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.4 t80 -65.68 -54.62 25.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -73.47 -33.59 64.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.867 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.421 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 44.0 tt0 -70.36 -23.05 62.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -90.83 -45.17 8.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.905 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.696 HG23 ' O ' ' B' ' 115' ' ' TYR . 87.6 t -60.8 -32.46 52.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.532 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.2 OUTLIER -58.15 -64.47 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.648 0.737 . . . . 0.0 110.864 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.532 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 54.2 Cg_endo -69.75 -50.41 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.712 2.275 . . . . 0.0 112.362 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -64.74 0.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.65 -31.96 2.75 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.496 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.1 -46.06 30.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.877 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.15 -41.0 77.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -52.21 58.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -64.43 -37.36 87.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.847 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.55 -51.81 46.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -64.59 -35.19 80.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -63.88 -45.63 88.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.065 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -60.04 -52.53 64.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -55.5 -54.54 42.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -61.52 -40.47 94.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 152' ' ' ALA . 2.6 t -60.03 -52.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -51.26 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.26 -45.61 93.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.073 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -40.21 81.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.937 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -66.15 -47.83 72.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 21.4 m -56.14 -42.64 77.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.132 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.37 -32.84 55.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.48 -19.22 62.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.02 -62.08 6.61 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.535 0.683 . . . . 0.0 111.043 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.5 Cg_endo -69.81 -46.52 1.18 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.669 2.246 . . . . 0.0 112.312 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 166' ' ' TYR . . . . . 0.506 ' O ' HD13 ' B' ' 170' ' ' LEU . 19.6 m-30 -56.68 -27.79 59.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.1 66.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.815 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -52.03 20.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.506 HD13 ' O ' ' B' ' 166' ' ' TYR . 8.9 mp -61.04 -49.17 78.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -61.46 -33.72 74.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.874 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.66 -52.16 65.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.892 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.16 -43.57 70.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.4 tp -60.82 -50.46 73.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.9 -32.87 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.97 60.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.101 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -73.84 -31.95 63.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.867 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.48 -48.74 66.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.11 -38.88 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -67.03 -46.96 72.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -60.85 -42.18 97.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.926 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -33.07 67.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -50.54 69.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -69.09 -26.39 64.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.43 -34.55 42.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.9 36.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.35 -25.76 42.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.809 0.338 . . . . 0.0 111.11 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -38.31 64.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -37.27 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.16 -48.79 40.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -47.74 82.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.49 -43.96 96.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.947 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.13 -47.51 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.841 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.15 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -76.01 -51.25 12.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.73 -45.7 77.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.071 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 197' ' ' THR . . . . . 0.474 HG21 HD13 ' A' ' 240' ' ' LEU . 94.9 m -59.58 -46.79 87.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.132 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -63.75 -38.6 91.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.848 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -58.62 -40.66 83.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.94 -32.0 64.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 201' ' ' SER . . . . . 0.706 ' OG ' HG23 ' A' ' 237' ' ' THR . 0.5 OUTLIER -57.78 -50.97 71.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.876 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.34 -51.24 59.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.184 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.82 -50.2 69.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.89 -35.26 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.65 -47.84 84.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -31.86 56.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.24 63.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.12 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.5 OUTLIER -60.55 -63.18 4.6 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 0.0 110.892 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -27.74 26.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.676 2.251 . . . . 0.0 112.365 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.37 -31.77 58.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.088 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.21 -36.28 69.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.81 -50.86 65.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.53 -34.2 65.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.824 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.38 -49.36 77.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.78 -36.16 83.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.84 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -57.03 -48.82 77.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.916 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.54 -29.46 74.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.508 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.25 -32.56 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.331 . . . . 0.0 110.883 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.4 OUTLIER -49.38 -60.86 4.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.597 0.713 . . . . 0.0 110.927 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 54.1 Cg_endo -69.69 -39.08 7.09 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.717 2.278 . . . . 0.0 112.383 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 49.0 t -58.21 -55.31 23.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.136 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -34.38 73.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.1 OUTLIER -66.63 -34.74 78.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -48.34 82.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.866 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.13 -42.62 79.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.08 -46.53 86.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' B' ' 223' ' ' GLU . 39.8 t -56.88 -39.92 68.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.142 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 28.5 m -58.73 -50.21 74.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.874 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.26 -36.77 80.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.475 ' HA ' HD21 ' B' ' 233' ' ' LEU . 1.8 tp -63.72 -34.31 77.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.55 -30.78 66.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.28 53.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.073 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.475 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.0 OUTLIER -67.61 -44.75 77.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -35.73 79.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -67.2 -48.91 66.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.838 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -54.22 -40.7 67.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 237' ' ' THR . . . . . 0.727 HG23 ' OG ' ' A' ' 201' ' ' SER . 96.9 m -73.07 -40.24 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.153 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.61 -54.75 40.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.903 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.06 -37.35 78.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.507 HD13 HG21 ' A' ' 197' ' ' THR . 2.2 tp -57.58 -38.24 74.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.869 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -172.92 87.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 1.5 m -51.48 128.79 23.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.156 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 179.989 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.8 m . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.7 t -71.98 -35.76 69.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.164 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -118.94 37.07 4.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -42.67 63.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.848 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -69.8 -41.04 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -45.49 93.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.908 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -65.85 -47.12 76.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.878 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -57.54 -43.2 84.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -77.51 -24.37 50.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.507 HD13 ' C ' ' A' ' 64' ' ' LEU . 3.5 tm? -53.98 -41.66 68.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.98 73.48 0.97 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.459 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -32.13 19.12 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.659 2.239 . . . . 0.0 112.336 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.0 m -55.59 -33.36 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.5 p -67.49 -47.34 70.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.098 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -54.8 -47.91 73.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.899 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.7 -30.42 69.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -59.28 5.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.902 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -68.4 -44.14 75.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -56.46 -49.53 74.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.85 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -63.02 -46.43 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -56.5 21.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.918 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.06 -34.9 72.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -56.59 -51.33 69.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -32.07 65.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.21 -24.75 67.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.158 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -50.91 -33.13 22.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.03 -26.84 9.24 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.508 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -47.4 -40.7 18.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.626 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.1 mtt-85 -59.44 -49.83 76.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.12 -47.39 85.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.75 -49.69 67.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -40.37 82.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -59.88 -50.78 72.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.7 -46.21 87.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.666 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.1 t0 -55.47 -47.66 75.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.83 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -48.1 80.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.55 -47.57 76.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -36.58 83.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.666 HG23 ' O ' ' A' ' 89' ' ' ASP . 72.9 t -66.58 -31.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.162 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -52.75 10.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.83 -33.71 75.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -77.35 -33.51 55.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -59.5 -42.15 87.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.103 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.536 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.1 OUTLIER -44.92 -64.73 0.78 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.611 0.72 . . . . 0.0 110.918 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.78 -31.52 20.25 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.679 2.253 . . . . 0.0 112.34 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.423 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 16.4 t80 -60.78 -24.88 66.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.937 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.23 -50.8 24.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.945 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -65.66 -34.24 77.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.858 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -47.32 77.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -52.26 66.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.84 -46.9 82.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.25 -22.58 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.902 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -71.46 -45.54 62.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.887 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -25.67 61.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.936 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -65.47 -59.53 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -67.83 -34.31 76.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.2 -31.46 68.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.916 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -68.41 -54.11 19.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.87 -34.74 78.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.929 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.74 -26.19 54.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.94 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.674 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -64.35 -54.57 30.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -33.28 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -71.34 -24.92 62.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -87.18 -47.07 9.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.674 HG23 ' O ' ' A' ' 115' ' ' TYR . 72.7 t -60.89 -31.27 49.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.158 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.537 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 3.7 mt-10 -54.74 -64.7 1.77 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.583 0.706 . . . . 0.0 110.838 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.7 Cg_endo -69.77 -54.96 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.41 -62.48 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.01 -31.52 4.32 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.83 -42.77 57.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.796 0.331 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.19 -35.26 66.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 16.6 mtp -67.1 -48.92 66.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -37.54 79.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.841 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -71.0 -52.05 21.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -63.28 -35.65 81.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.935 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.608 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.77 -41.25 96.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.063 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -62.76 -47.97 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.08 -32.57 67.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -69.67 -50.43 44.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' VAL . . . . . 0.608 HG12 ' O ' ' A' ' 152' ' ' ALA . 14.6 p -66.26 -41.2 88.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.443 ' N ' HG13 ' A' ' 156' ' ' VAL . 25.6 t70 -53.39 -52.86 57.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.37 -48.36 75.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.2 -38.55 73.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -44.08 78.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.61 -42.99 79.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -80.95 -29.77 35.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 34.8 tp -70.69 -18.2 62.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' ALA . . . . . 0.804 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.95 -63.11 4.63 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.572 0.701 . . . . 0.0 111.106 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.804 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.3 Cg_endo -69.71 -44.88 1.85 Allowed 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.722 2.281 . . . . 0.0 112.356 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' TYR . . . . . 0.57 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 15.3 t80 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.907 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.6 -49.18 72.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.17 -46.66 87.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.3 -52.33 54.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.57 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 17.8 tp -58.59 -47.69 83.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 8.7 mmp_? -56.56 -38.31 71.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.929 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.62 -49.14 77.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -61.03 -47.72 85.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.917 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.92 -46.01 89.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -36.22 65.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.22 -34.7 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -33.6 76.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 8.9 tt -73.61 -49.39 26.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -50.3 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.68 73.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.108 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.02 -35.83 79.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -65.25 -27.8 68.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.4 -56.6 15.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.58 -48.36 77.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -56.05 -32.28 59.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.493 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.46 71.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.25 -54.24 7.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 0.0 111.121 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -55.75 -28.62 56.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 11.4 tp -56.09 -47.32 78.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.56 58.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.08 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -60.32 -34.16 73.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.51 -47.25 79.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.91 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.51 -47.63 72.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.55 -30.71 71.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.12 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -49.67 20.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.34 87.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.116 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.02 -47.03 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.72 -39.49 91.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.85 -38.03 77.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -34.17 65.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.948 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 201' ' ' SER . . . . . 0.647 ' HB3' HG23 ' B' ' 237' ' ' THR . 8.4 m -57.15 -50.74 71.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.819 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.37 -51.43 60.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.143 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.53 -47.76 72.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.914 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 24.6 p -59.33 -33.71 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.801 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.57 -46.97 88.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.56 -32.26 58.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.6 -20.35 63.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.498 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -59.85 -62.82 5.12 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.593 0.711 . . . . 0.0 110.929 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.77 -27.34 26.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.693 2.262 . . . . 0.0 112.352 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.62 -35.59 60.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.126 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.75 -34.87 74.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.954 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -51.05 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -71.25 -34.65 70.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.88 -50.34 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -36.35 83.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -56.81 -48.56 77.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.954 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' GLY . . . . . 0.575 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.64 -29.26 74.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.51 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.03 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.6 OUTLIER -48.77 -60.73 4.13 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.627 0.727 . . . . 0.0 110.938 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 220' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.9 Cg_endo -69.75 -38.56 7.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.68 2.253 . . . . 0.0 112.367 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.0 t -58.17 -54.22 35.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -35.0 74.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.91 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 223' ' ' GLU . . . . . 0.627 ' O ' HG13 ' A' ' 227' ' ' VAL . 2.2 mt-10 -63.49 -37.29 86.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.899 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 -45.81 92.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.5 -36.46 68.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.64 -51.78 56.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 223' ' ' GLU . 30.0 m -57.62 -35.97 52.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.106 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.7 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 230' ' ' LEU . . . . . 0.579 HD13 HD11 ' A' ' 233' ' ' LEU . 2.9 mm? -63.48 -33.71 76.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -31.45 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.79 -51.7 52.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' LEU . . . . . 0.579 HD11 HD13 ' A' ' 230' ' ' LEU . 0.9 OUTLIER -67.9 -46.08 72.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.935 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.47 -36.22 75.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.22 -48.78 72.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -54.04 -39.84 66.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.939 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 237' ' ' THR . . . . . 0.699 HG23 ' HB3' ' B' ' 201' ' ' SER . 78.5 m -65.58 -46.45 79.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -55.07 37.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.867 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -44.85 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 240' ' ' LEU . . . . . 0.665 HD23 ' OG1' ' A' ' 242' ' ' THR . 0.6 OUTLIER -56.78 -35.03 68.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 74.73 61.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.907 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 242' ' ' THR . . . . . 0.665 ' OG1' HD23 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -127.36 39.21 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.942 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.958 0.408 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 9.7 t -71.98 -35.8 69.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.101 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -119.06 37.56 4.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.855 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.68 -42.64 64.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -69.94 -41.42 74.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.88 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.84 -45.89 91.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -65.66 -47.3 75.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -57.14 -43.43 82.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -77.51 -24.11 50.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.492 HD13 ' C ' ' B' ' 64' ' ' LEU . 3.4 tm? -53.91 -41.1 67.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.96 73.24 0.96 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.482 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -32.08 19.42 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.705 2.27 . . . . 0.0 112.348 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 25.2 m -55.37 -35.8 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 16.6 p -66.1 -42.23 89.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -58.02 -52.77 64.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.54 -28.9 69.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -62.61 1.75 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.892 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 25.6 p-90 -67.46 -32.84 73.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.48 -52.03 60.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.864 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -63.28 -43.39 98.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.898 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -56.84 16.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.15 -34.96 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -56.65 -51.32 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -32.21 66.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -62.02 -24.86 67.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.12 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -51.06 -33.33 25.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.817 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.15 -26.93 9.71 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.437 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.62 HD23 ' N ' ' B' ' 83' ' ' ARG . 0.0 OUTLIER -47.38 -40.54 17.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.911 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ARG . . . . . 0.62 ' N ' HD23 ' B' ' 82' ' ' LEU . 5.1 mtt-85 -59.58 -49.77 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.26 -47.26 86.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.81 -49.7 67.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -40.05 81.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.878 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 51.4 m -60.08 -50.59 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.83 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.89 -46.28 88.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' ASP . . . . . 0.681 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.0 t0 -55.29 -47.92 74.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.895 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.55 -47.58 81.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.64 -47.45 76.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 -36.65 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.2 t -66.54 -31.23 52.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -53.02 9.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.43 -34.74 75.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -77.86 -33.96 51.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.02 -45.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.149 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.559 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.2 OUTLIER -44.08 -66.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.592 0.71 . . . . 0.0 110.952 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.559 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.81 -30.48 21.99 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.668 2.245 . . . . 0.0 112.313 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.4 t80 -60.89 -24.07 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -76.33 -50.6 13.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -60.99 -34.66 75.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -47.22 72.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -52.4 65.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.96 -47.59 79.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.06 -22.11 66.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 23.2 tptt -72.34 -46.49 55.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.856 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -26.41 63.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -65.98 -59.98 3.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.83 -34.56 78.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.34 -30.42 67.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -68.81 -54.13 17.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -66.65 -34.45 77.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.71 -26.1 54.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' TYR . . . . . 0.655 ' O ' HG23 ' B' ' 119' ' ' VAL . 6.2 t80 -65.85 -54.2 29.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 -33.35 65.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.833 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.408 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 56.6 tt0 -71.57 -24.12 61.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -88.47 -48.68 7.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.906 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' B' ' 115' ' ' TYR . 70.5 t -59.88 -31.54 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.088 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.7 mt-10 -55.59 -64.64 2.01 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.628 0.728 . . . . 0.0 110.88 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.7 Cg_endo -69.81 -52.73 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.71 2.274 . . . . 0.0 112.304 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.47 -63.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.74 -31.25 2.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -77.59 -45.78 24.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 0.0 110.893 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -68.7 -46.64 68.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.94 -51.82 65.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -60.52 -42.14 95.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -66.46 -51.4 57.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -60.86 -32.08 71.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.666 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -64.76 -47.83 76.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -58.81 -45.82 89.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.868 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.3 -33.52 67.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.09 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -69.0 -50.36 49.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' VAL . . . . . 0.666 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.6 p -65.17 -41.13 90.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 157' ' ' ASP . . . . . 0.408 ' N ' HG13 ' B' ' 156' ' ' VAL . 25.7 t70 -53.26 -52.68 58.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -48.73 73.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.076 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.16 -37.92 72.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -44.24 77.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.849 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.71 -42.41 79.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -81.43 -29.77 33.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 35.1 tp -70.86 -18.29 62.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.949 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -59.69 -62.96 4.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.589 0.709 . . . . 0.0 111.123 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.79 -44.0 2.31 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.703 2.269 . . . . 0.0 112.35 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 166' ' ' TYR . . . . . 0.582 ' CE2' HD22 ' B' ' 170' ' ' LEU . 15.8 t80 -58.41 -27.76 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 1.1 m -64.19 -48.74 74.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -62.1 -47.28 85.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.872 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.09 -52.26 56.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 170' ' ' LEU . . . . . 0.582 HD22 ' CE2' ' B' ' 166' ' ' TYR . 17.0 tp -58.47 -48.32 81.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 8.8 mmp_? -56.5 -37.33 70.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.45 -45.34 91.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.89 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -63.73 -47.58 80.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.842 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.28 -43.58 94.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.22 -36.99 69.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.94 -34.62 64.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.135 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -33.57 76.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 9.0 tt -73.49 -48.98 29.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.939 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.59 56.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.86 -49.45 73.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.64 -36.11 81.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.2 -27.73 68.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.922 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.48 -56.29 18.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.66 -46.84 83.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.906 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -57.43 -32.45 64.36 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.7 71.55 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.537 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.14 -54.11 7.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -55.77 -28.57 56.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.97 -47.77 77.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.911 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.66 -48.56 59.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.25 -34.09 73.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.934 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -64.48 -47.28 79.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.923 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.5 -47.85 72.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.86 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.33 -30.71 71.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.064 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -49.76 20.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.07 -39.19 86.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.0 -46.99 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.124 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.99 -39.25 90.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.93 -38.04 78.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.21 -34.22 65.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.946 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 201' ' ' SER . . . . . 0.699 ' HB3' HG23 ' A' ' 237' ' ' THR . 8.4 m -57.1 -50.67 72.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.44 -51.35 60.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.118 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -47.86 72.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.969 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 24.3 p -59.35 -33.53 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.58 -47.01 88.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.915 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -32.41 58.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.49 -20.25 63.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.51 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -60.0 -62.92 4.92 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.589 0.709 . . . . 0.0 110.888 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 209' ' ' PRO . . . . . 0.51 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.2 Cg_endo -69.77 -27.13 26.79 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.717 2.278 . . . . 0.0 112.347 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.81 -35.65 59.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.121 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 18.4 mt -69.66 -34.7 74.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.941 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.47 -50.94 64.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -71.21 -34.79 71.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.72 -50.53 73.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -36.31 83.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -56.76 -48.6 77.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.59 -29.24 74.44 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.526 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 7.9 tp -66.08 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 219' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.6 OUTLIER -48.7 -60.77 4.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 220' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.78 -38.58 7.56 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.677 2.251 . . . . 0.0 112.339 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 47.7 t -58.09 -54.28 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -35.12 74.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 223' ' ' GLU . . . . . 0.628 ' O ' HG13 ' B' ' 227' ' ' VAL . 2.2 mt-10 -63.35 -37.17 86.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.921 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 224' ' ' SER . . . . . 0.41 ' O ' HG22 ' B' ' 227' ' ' VAL . 1.5 m -60.51 -45.81 92.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.45 -36.47 68.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.61 -51.76 57.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 227' ' ' VAL . . . . . 0.628 HG13 ' O ' ' B' ' 223' ' ' GLU . 30.9 m -57.6 -35.97 52.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.151 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -51.38 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.72 -38.12 89.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.932 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 230' ' ' LEU . . . . . 0.587 HD13 HD11 ' B' ' 233' ' ' LEU . 2.9 mm? -63.53 -33.68 76.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -31.37 67.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.81 -51.65 53.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 233' ' ' LEU . . . . . 0.587 HD11 HD13 ' B' ' 230' ' ' LEU . 0.9 OUTLIER -67.97 -46.09 72.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.4 -36.36 75.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.12 -48.76 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -53.98 -39.88 66.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 237' ' ' THR . . . . . 0.647 HG23 ' HB3' ' A' ' 201' ' ' SER . 78.3 m -65.6 -46.41 79.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.142 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -55.08 36.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.865 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -44.83 80.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.895 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.66 HD23 ' OG1' ' B' ' 242' ' ' THR . 0.6 OUTLIER -56.74 -35.03 68.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 74.78 60.93 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 242' ' ' THR . . . . . 0.66 ' OG1' HD23 ' B' ' 240' ' ' LEU . 0.2 OUTLIER -127.13 39.01 3.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.121 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.905 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.841 0.353 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -57.5 11.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -58.03 -35.21 70.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.922 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -58.62 -52.07 67.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.94 -32.83 63.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.887 HG22 HD23 ' A' ' 82' ' ' LEU . 95.0 m -62.14 -25.96 68.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.168 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.76 -34.38 27.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.91 -27.76 14.61 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.441 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.887 HD23 HG22 ' A' ' 79' ' ' THR . 2.3 pp -48.62 -37.31 17.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.831 0.348 . . . . 0.0 110.921 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -59.65 -44.71 93.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.93 -49.61 73.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 6.4 mtp -58.16 -41.56 84.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.75 -50.61 73.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.58 -44.34 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.71 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER -56.5 -47.41 79.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.45 -49.67 75.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -54.34 -47.8 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.06 -34.92 79.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.94 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 89' ' ' ASP . 69.3 t -66.41 -32.3 57.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.14 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -74.93 -52.91 10.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.54 -33.65 75.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -77.53 -33.42 54.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -58.67 -43.07 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.136 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 5.6 mm-40 -44.38 -65.05 0.66 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.586 0.708 . . . . 0.0 110.908 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.4 Cg_endo -69.77 -32.27 18.85 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.672 2.248 . . . . 0.0 112.332 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 14.7 t80 -58.94 -25.26 63.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.9 mt -72.5 -50.64 24.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.59 -34.17 77.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -47.74 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.69 -52.22 65.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.74 -45.59 85.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -63.2 -22.61 66.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -73.25 -47.15 45.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -28.41 68.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -66.27 -56.46 11.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -70.28 -34.63 73.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.44 -32.53 71.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -69.2 -54.2 16.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -35.03 79.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.869 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.64 -26.25 54.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.76 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.0 t80 -63.33 -55.35 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -73.61 -36.02 65.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.851 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 72.6 tp60 -67.93 -22.56 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -89.07 -36.23 15.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 115' ' ' TYR . 85.5 t -64.86 -32.55 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.9 tt0 -59.56 -61.83 7.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.651 0.739 . . . . 0.0 110.859 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.6 Cg_endo -69.7 -52.32 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.677 2.251 . . . . 0.0 112.395 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 28.4 tp -69.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.89 -32.42 2.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.67 -44.66 32.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.814 0.34 . . . . 0.0 110.916 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.71 -42.63 81.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 35.4 mmt -66.82 -47.47 71.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.41 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.3 tpp85 -64.53 -42.94 95.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.8 -52.77 22.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -59.99 -34.9 73.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.844 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.34 -41.67 96.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.099 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -63.27 -48.27 78.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.03 71.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.101 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -69.31 -50.69 44.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.1 p -66.41 -41.58 89.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.463 ' N ' HG13 ' A' ' 156' ' ' VAL . 16.9 t70 -52.85 -52.26 57.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.93 75.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -39.27 74.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.947 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -45.12 75.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.908 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 22.6 m -55.88 -41.83 75.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.69 -31.5 32.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.13 -22.76 62.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.823 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.63 -62.56 3.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.577 0.703 . . . . 0.0 111.142 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.823 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.5 Cg_endo -69.83 -44.17 2.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -59.13 -31.37 68.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.938 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.8 t -56.71 -52.12 66.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.875 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.59 -47.57 80.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.871 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.8 -51.28 69.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.511 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.0 tm? -58.95 -44.71 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.21 -35.57 67.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -50.04 60.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.54 -40.11 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.6 tp -70.0 -49.82 47.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . 0.54 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.92 -34.31 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.15 -34.22 56.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.125 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -62.11 -49.05 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 175' ' ' ALA . 1.5 pp -66.99 -49.31 65.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . 0.523 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.9 OUTLIER -59.39 -49.59 77.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.84 -46.8 78.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.86 -39.67 74.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -67.55 -28.17 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.868 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.75 -56.1 20.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.848 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.84 -27.53 65.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.16 -31.25 65.24 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.3 -48.7 66.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.48 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.25 -23.1 38.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.766 0.317 . . . . 0.0 111.054 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.81 -30.53 62.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.816 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -43.62 98.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.8 -48.82 43.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.097 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.94 -50.52 73.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -56.12 -46.7 79.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.919 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.19 -50.73 61.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.844 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.36 -31.01 68.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.123 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.41 -49.09 17.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.48 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.0 m -66.58 -48.36 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.147 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 26.3 pt-20 -70.86 -36.1 72.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -58.88 -47.64 84.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 mp -72.29 -29.8 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 58.0 m -56.91 -51.2 70.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 37.0 p -69.39 -50.35 46.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.151 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.41 -55.57 27.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 61.4 m -54.43 -35.88 63.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.875 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.85 -46.99 86.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -78.35 -27.84 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.04 -21.65 63.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.131 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.48 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -62.35 -60.71 9.26 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.561 0.696 . . . . 0.0 110.871 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 54.3 Cg_endo -69.72 -28.34 25.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.685 2.257 . . . . 0.0 112.366 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.78 -31.59 57.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.15 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.8 -38.39 73.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -54.19 -50.57 66.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.03 -31.18 58.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.849 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.59 -52.11 66.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -35.57 78.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.848 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -57.2 -48.91 77.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.866 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.82 -29.79 72.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.481 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.36 -32.4 73.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.8 OUTLIER -52.48 -61.65 4.31 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.595 0.712 . . . . 0.0 110.896 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.78 -43.79 2.44 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.661 2.241 . . . . 0.0 112.364 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 217' ' ' GLY . 57.0 t -57.2 -55.08 22.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.14 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.73 -33.19 71.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.621 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -68.43 -34.98 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.92 83.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.858 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -65.6 -42.57 91.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.34 -44.84 90.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 223' ' ' GLU . 42.9 t -55.54 -42.69 69.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.102 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -49.82 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -65.08 -38.5 90.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 233' ' ' LEU . 2.3 mm? -64.96 -34.05 77.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.21 -30.98 65.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.88 56.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.069 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -67.18 -36.54 81.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.945 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.16 -35.97 69.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.78 -49.14 32.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.87 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.31 -37.27 80.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.9 m -71.04 -46.37 62.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.161 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -56.46 -53.93 51.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.87 -48.79 78.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.9 -34.53 69.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.45 -57.47 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.946 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.12 -35.3 71.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -58.47 -52.2 66.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -32.81 63.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . 0.861 HG22 HD23 ' B' ' 82' ' ' LEU . 95.3 m -62.09 -25.92 67.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.168 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -34.39 27.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.9 -27.71 14.43 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.488 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.861 HD23 HG22 ' B' ' 79' ' ' THR . 2.4 pp -48.7 -37.51 18.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.778 0.323 . . . . 0.0 110.913 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.64 -49.78 76.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -59.68 -44.87 93.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.92 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.73 -49.71 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 6.3 mtp -58.26 -41.42 84.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.79 -50.58 73.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.89 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.64 -44.43 90.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.2 OUTLIER -56.28 -47.82 77.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.37 -49.39 76.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.35 -47.4 72.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.929 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.68 -34.95 79.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.9 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' B' ' 89' ' ' ASP . 76.1 t -66.48 -32.15 56.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.159 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -75.5 -53.29 8.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.91 75.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.104 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -77.76 -33.69 52.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.881 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -55.43 -46.43 78.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.561 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 5.2 mm-40 -43.48 -66.24 0.47 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.576 0.703 . . . . 0.0 110.913 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.561 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.73 -31.46 20.62 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 0.0 112.349 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.5 t80 -58.66 -24.7 61.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.88 -50.14 15.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.929 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.83 -34.38 73.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.69 -47.56 69.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.09 -52.61 63.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.31 -46.16 84.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -62.2 -22.56 66.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.872 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -72.95 -47.41 45.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.89 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.86 -30.82 71.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -63.98 -56.4 15.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.14 -34.29 72.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -70.57 -31.68 68.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.904 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . 0.41 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 1.2 tmt? -69.95 -54.48 13.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.15 -35.52 81.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.51 -25.94 54.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.953 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.9 t80 -63.13 -55.57 24.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.932 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -74.43 -33.94 63.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.443 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 72.6 tp60 -69.58 -21.93 63.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -91.24 -36.31 13.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 97.2 t -65.68 -32.62 58.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.475 ' N ' ' HD2' ' B' ' 143' ' ' PRO . 2.8 tt0 -60.67 -61.45 7.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.672 0.749 . . . . 0.0 110.89 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.75 -51.54 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.342 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 23.3 tp -70.84 -64.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.4 -32.21 1.76 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.462 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -77.74 -47.32 19.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 110.882 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 -45.68 78.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.5 mmt -64.91 -51.94 59.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.836 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.7 tpp85 -60.29 -43.59 96.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -66.75 -51.69 52.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.848 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.49 -31.91 70.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.655 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.48 -47.27 76.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.088 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 12.8 tpt85 -59.16 -45.3 91.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.65 -34.19 67.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.133 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . 0.438 ' CE1' HD13 ' B' ' 159' ' ' LEU . 49.1 t-80 -68.87 -50.05 53.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.83 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.655 HG12 ' O ' ' B' ' 152' ' ' ALA . 8.7 p -65.23 -41.36 91.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . 0.426 ' N ' HG13 ' B' ' 156' ' ' VAL . 17.1 t70 -53.06 -51.95 60.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.05 -48.55 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.438 HD13 ' CE1' ' B' ' 155' ' ' HIS . 0.2 OUTLIER -57.37 -37.93 73.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -44.96 74.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 22.8 m -56.15 -41.86 76.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.164 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.56 -31.14 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.87 -22.64 62.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.837 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.84 -62.52 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.577 0.703 . . . . 0.0 111.121 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.837 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.76 -42.43 3.41 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.71 2.273 . . . . 0.0 112.35 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -60.74 -31.16 70.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.943 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.7 t -57.4 -51.85 67.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.829 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.23 -47.64 81.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.27 -51.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.877 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.512 ' O ' HD22 ' B' ' 170' ' ' LEU . 2.0 tm? -58.86 -44.45 91.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.36 -36.07 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -49.44 64.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.25 -41.47 96.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 25.1 tp -69.27 -48.94 60.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.939 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . 0.534 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.1 -34.34 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.102 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.41 57.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.124 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -61.98 -48.89 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' B' ' 175' ' ' ALA . 1.6 pp -67.32 -48.96 66.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . 0.53 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.9 OUTLIER -59.3 -50.32 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.61 77.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.063 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -57.13 -39.39 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -68.3 -28.23 67.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -55.76 23.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.854 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.92 -27.38 65.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.24 -31.41 65.8 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.18 -48.81 66.09 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.473 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.15 -23.18 38.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.318 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.72 -30.53 62.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -43.77 98.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.84 -48.68 44.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.117 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.96 -50.41 73.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -56.38 -46.69 79.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.17 -50.22 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.85 -30.97 69.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.3 -48.95 18.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.26 -34.12 76.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.1 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.4 m -65.87 -48.66 70.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -70.91 -36.15 72.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.82 -47.56 84.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.37 -29.75 64.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.926 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 57.7 m -56.98 -51.09 70.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.848 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 36.6 p -69.37 -50.27 47.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.158 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.49 -55.58 27.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.879 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 61.3 m -54.51 -35.85 63.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.835 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.87 -46.88 86.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.888 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -78.47 -27.83 46.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.11 -21.74 63.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.485 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -62.27 -60.75 9.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.554 0.692 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.8 -28.25 25.28 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.711 2.274 . . . . 0.0 112.333 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.95 -31.55 56.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.126 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.62 -38.5 73.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.926 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -54.12 -50.43 66.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -75.88 -31.11 59.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.72 -52.22 66.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -35.46 78.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -57.21 -48.87 77.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.491 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.89 -29.82 72.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.493 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.31 -32.47 73.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.8 OUTLIER -52.45 -61.67 4.27 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.616 0.722 . . . . 0.0 110.923 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 54.0 Cg_endo -69.73 -43.83 2.45 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 0.0 112.398 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.491 HG23 ' O ' ' B' ' 217' ' ' GLY . 56.6 t -57.23 -55.11 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.171 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -33.32 71.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.632 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.4 mt-10 -68.45 -34.92 76.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -47.96 83.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.856 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -65.64 -42.4 91.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.42 -44.9 89.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.867 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.632 HG23 ' O ' ' B' ' 223' ' ' GLU . 43.0 t -55.53 -42.67 69.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.14 -49.82 76.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -65.1 -38.53 91.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.508 HD13 HD11 ' B' ' 233' ' ' LEU . 2.3 mm? -64.87 -34.09 77.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.907 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.26 -30.91 65.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.55 -50.75 57.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.508 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -67.31 -36.42 81.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.2 -36.06 69.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.73 -49.13 33.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.877 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -60.35 -37.24 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.925 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 98.1 m -70.99 -46.44 62.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.169 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 7.1 ttmt -56.45 -53.9 51.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.84 -48.81 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 29.6 mt -57.92 -34.55 69.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.925 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.838 0.351 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' A' ' 79' ' ' THR . 35.1 tp -59.85 -55.26 36.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.948 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.61 -33.81 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.885 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.18 -49.4 74.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.54 -34.01 76.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 75' ' ' LEU . 28.8 p -73.11 -23.45 60.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -50.96 -31.96 19.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.32 -30.7 40.95 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 79' ' ' THR . 2.6 pp -51.67 -36.88 48.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.35 -49.67 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.876 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.23 -41.73 98.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.04 -48.08 81.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.3 mmt -62.5 -40.09 95.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -58.76 -50.24 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.869 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -60.56 -46.24 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 20.3 t70 -55.62 -47.59 76.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.888 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tp -58.15 -50.85 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.08 66.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.836 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -62.64 -37.96 88.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.893 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 96.2 t -65.34 -31.68 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.138 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -74.93 -53.93 8.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.895 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.57 -30.67 71.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.96 -36.11 42.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.34 -43.33 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.187 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.551 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.9 mm-40 -44.33 -65.23 0.64 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.61 0.719 . . . . 0.0 110.943 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.551 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.9 Cg_endo -69.8 -27.27 26.46 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -53.72 -57.29 11.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.628 HD23 ' HB3' ' B' ' 160' ' ' ARG . 1.7 mp -53.65 -29.13 36.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.929 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.82 -47.04 73.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.04 -42.83 93.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -50.74 72.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.883 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -47.5 85.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -26.2 68.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -45.79 67.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.868 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -23.17 61.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -66.21 -64.83 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -63.4 -34.78 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.892 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -70.51 -30.07 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.874 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.408 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 1.2 tmt? -65.65 -51.64 57.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.852 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -40.67 96.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -25.34 56.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.773 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.6 t80 -61.92 -54.97 34.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -71.18 -39.26 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.854 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -65.28 -25.67 67.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.35 -40.91 12.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.9 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 115' ' ' TYR . 59.0 t -57.61 -31.76 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.544 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.9 mt-10 -60.12 -65.09 2.31 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.587 0.708 . . . . 0.0 110.868 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.544 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 54.1 Cg_endo -69.73 -51.42 0.39 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.714 2.276 . . . . 0.0 112.374 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -63.61 1.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.907 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.18 -31.84 1.48 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.481 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -75.37 -43.58 49.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 0.0 110.857 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -71.83 -37.37 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -67.54 -47.74 69.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.834 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.403 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 9.3 tpp180 -66.31 -39.92 89.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.87 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -71.37 -51.34 24.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -62.46 -38.27 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.22 -42.47 99.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.79 -50.91 70.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.05 70.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.084 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.16 -50.6 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 10.7 p -67.34 -35.53 74.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.129 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -57.3 -51.25 70.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.01 56.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.087 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 22.2 tp -56.76 -42.57 79.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.587 ' HB3' HD23 ' B' ' 101' ' ' LEU . 0.6 OUTLIER -68.47 -38.88 81.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.88 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 61.8 m -56.95 -47.61 80.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.09 -34.9 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.87 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.3 tp -72.31 -15.08 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.815 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -62.3 -62.05 6.5 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.609 0.719 . . . . 0.0 111.15 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.815 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.73 -39.4 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.364 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -63.16 -34.22 77.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.95 -48.58 73.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -62.02 -49.39 76.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.46 -51.07 68.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 31.7 tp -60.62 -50.04 75.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.57 -34.01 76.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.833 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.23 79.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -49.02 38.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.867 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -51.47 47.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.31 -43.02 74.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.109 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.95 -39.35 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.05 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -33.43 75.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.887 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.76 -50.17 26.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.39 -50.93 57.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.27 76.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.086 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 18.8 tp -63.79 -34.78 78.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -65.28 -33.54 76.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.82 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.53 -45.16 77.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -67.56 -26.28 66.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.12 -33.57 37.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.445 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.1 -32.3 35.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.502 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.25 -25.74 42.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 111.133 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.75 -35.25 65.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -37.18 86.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.907 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.33 38.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.063 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -49.08 77.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.47 -42.69 92.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.84 -50.16 66.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.96 -30.92 70.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.088 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.36 -49.73 18.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.66 -34.82 77.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.156 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.1 m -64.23 -47.67 78.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.14 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.87 -37.77 79.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -42.85 90.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -30.95 64.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 20.3 m -57.18 -51.02 70.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.865 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 4.8 p -67.74 -50.38 57.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.159 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.0 tp -55.06 -53.06 60.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 14.1 m -54.64 -36.17 64.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.814 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -46.27 88.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -28.85 48.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.896 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.08 62.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.489 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 4.4 tptt -61.07 -60.37 10.85 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.589 0.709 . . . . 0.0 110.893 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.71 -29.16 24.54 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.694 2.263 . . . . 0.0 112.41 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.54 -29.82 56.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.085 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tt -72.54 -38.66 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.91 -51.22 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.883 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.75 -31.25 61.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.4 HD23 ' N ' ' A' ' 215' ' ' ARG . 4.7 tt -62.91 -52.46 62.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.95 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . 0.4 ' N ' HD23 ' A' ' 214' ' ' LEU . 36.7 ttp180 -63.7 -37.76 88.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.874 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -56.67 -48.32 77.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.75 -29.25 74.42 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.457 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.88 -33.07 74.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.836 0.351 . . . . 0.0 110.883 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.1 mp -48.3 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.583 0.706 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.2 Cg_endo -69.78 -37.72 8.74 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.683 2.255 . . . . 0.0 112.324 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 217' ' ' GLY . 47.2 t -58.55 -54.87 27.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.172 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -34.98 74.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.6 OUTLIER -65.22 -34.62 78.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.15 -48.43 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.31 -43.18 70.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -62.49 -48.86 77.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.828 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 223' ' ' GLU . 24.9 t -56.74 -38.78 59.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.56 -50.1 75.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.865 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.78 -38.48 90.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.762 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -65.22 -34.76 79.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 10.8 m -70.14 -30.42 67.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.829 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.16 48.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.123 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.762 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -69.2 -38.99 78.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.65 -39.65 84.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -72.26 -48.62 41.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.7 -35.89 69.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 93.9 m -70.73 -47.33 60.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.109 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -53.79 52.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -61.73 -48.72 79.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.83 -35.09 70.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 179.919 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.886 0.374 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' B' ' 79' ' ' THR . 35.0 tp -59.86 -55.34 35.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.52 -33.82 76.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.876 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -49.51 73.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.46 -34.05 76.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.877 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' B' ' 75' ' ' LEU . 28.8 p -73.14 -23.4 60.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.03 -31.93 19.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.893 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.42 -30.7 41.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.476 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.504 HD23 ' O ' ' B' ' 79' ' ' THR . 2.5 pp -51.65 -36.79 47.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -58.49 -49.61 76.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.11 -42.01 98.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.923 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.74 -48.39 79.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.2 mmt -62.27 -40.0 94.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 44.4 m -58.63 -50.23 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.835 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -60.45 -46.52 89.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.709 ' O ' HG23 ' B' ' 93' ' ' VAL . 20.3 t70 -55.44 -47.97 75.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.891 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.86 -50.78 72.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.11 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.12 -36.66 84.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.925 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 89' ' ' ASP . 97.3 t -66.45 -31.76 55.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -75.21 -54.93 6.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.18 72.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.68 -36.57 43.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -54.22 -47.45 67.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.108 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.57 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.0 mm-40 -42.68 -66.76 0.39 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.562 0.696 . . . . 0.0 110.904 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.57 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.69 -24.32 30.12 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.703 2.268 . . . . 0.0 112.339 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -53.54 -54.98 29.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.941 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.587 HD23 ' HB3' ' A' ' 160' ' ' ARG . 0.3 OUTLIER -59.46 -28.36 66.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.87 -48.49 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.848 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.28 -43.94 84.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -51.54 67.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.877 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -47.52 85.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.25 -25.48 64.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.97 -48.93 41.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.918 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -25.63 67.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -68.02 -66.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.9 -35.51 76.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.858 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -70.96 -29.3 65.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.902 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . 0.403 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 0.8 OUTLIER -65.49 -51.37 60.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.826 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -39.11 93.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -25.72 56.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.895 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.726 ' O ' HG23 ' B' ' 119' ' ' VAL . 17.6 t80 -64.23 -55.58 20.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.974 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -69.4 -38.61 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -66.6 -24.51 66.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -91.79 -42.56 10.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.726 HG23 ' O ' ' B' ' 115' ' ' TYR . 62.2 t -56.98 -31.47 36.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.527 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mt-10 -61.45 -64.85 2.61 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.649 0.738 . . . . 0.0 110.904 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.527 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.4 Cg_endo -69.74 -51.82 0.36 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -63.95 1.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.99 -31.0 1.11 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -77.2 -45.21 27.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -70.24 -43.84 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -64.9 -51.2 63.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.408 ' HG3' ' HG3' ' A' ' 112' ' ' MET . 10.3 tpp180 -62.09 -41.09 97.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.857 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -68.31 -50.92 50.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.815 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -62.26 -33.73 75.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.57 -49.68 72.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.09 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -56.66 -49.54 74.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.897 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.99 -32.93 72.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.106 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.5 -50.15 60.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.837 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.3 -35.55 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.13 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -57.6 -50.78 72.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.1 58.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.109 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 22.0 tp -57.37 -42.21 81.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . 0.628 ' HB3' HD23 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -67.64 -39.54 84.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 86.1 m -57.25 -46.88 82.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.48 -34.94 47.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 tp -72.4 -15.37 61.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.93 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.794 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -62.13 -61.96 6.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.582 0.706 . . . . 0.0 111.076 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.794 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.73 -38.7 7.5 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -63.86 -34.95 79.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.02 -48.37 76.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -62.2 -49.24 76.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.867 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.4 -51.16 68.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.912 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.61 -50.1 74.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.35 -33.9 76.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -35.33 80.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -48.82 41.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.38 48.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.888 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.56 -42.75 75.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.04 -39.11 63.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.142 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -34.15 77.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.892 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 178' ' ' LEU . 0.4 OUTLIER -72.52 -49.35 33.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -67.19 -50.48 60.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.71 80.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 19.1 tp -64.36 -34.51 78.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -66.62 -33.77 76.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -44.71 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.875 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -68.05 -26.09 65.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.09 -33.59 37.7 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.482 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.0 -32.38 34.58 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.459 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.68 42.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.339 . . . . 0.0 111.128 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.73 -35.69 65.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -37.35 86.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.85 -49.25 39.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.137 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -48.44 79.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.88 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.92 -42.83 94.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.88 -49.99 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.83 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.07 -30.91 70.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.53 -49.6 18.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.71 -35.03 78.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 63.5 m -64.16 -47.56 79.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.163 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.85 -37.88 79.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.847 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -42.74 90.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.849 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.0 -30.9 64.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 20.2 m -57.28 -50.95 71.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 4.9 p -67.68 -50.38 57.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.9 tp -55.09 -53.04 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 13.9 m -54.71 -36.12 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.828 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -46.23 88.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.859 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -28.78 48.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.15 62.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.494 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 4.5 tptt -61.12 -60.3 11.06 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.564 0.697 . . . . 0.0 110.876 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.7 Cg_endo -69.8 -29.17 24.09 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.663 2.242 . . . . 0.0 112.3 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -29.76 56.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.109 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.39 -38.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.84 -51.03 64.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.81 -31.27 61.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.413 HD23 ' N ' ' B' ' 215' ' ' ARG . 4.7 tt -62.93 -52.45 62.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.919 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . 0.413 ' N ' HD23 ' B' ' 214' ' ' LEU . 36.5 ttp180 -63.88 -37.6 88.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -56.64 -48.4 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.581 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.79 -29.3 74.49 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.482 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.74 -33.13 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.886 0.374 . . . . 0.0 110.956 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.1 mp -48.28 -60.79 3.87 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 0.0 110.916 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.8 Cg_endo -69.72 -37.72 8.88 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.675 2.25 . . . . 0.0 112.328 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.581 HG23 ' O ' ' B' ' 217' ' ' GLY . 46.3 t -58.65 -54.81 28.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.51 -35.12 75.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.465 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.6 OUTLIER -65.15 -34.61 78.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.844 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.18 -48.46 79.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.789 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.27 -43.21 70.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.1 tttm -62.49 -48.83 77.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 223' ' ' GLU . 24.8 t -56.69 -38.82 59.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.55 -50.13 74.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.82 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -38.48 90.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.907 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.765 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -65.23 -34.82 79.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.937 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 10.4 m -70.05 -30.41 67.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.45 -50.22 47.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.765 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -69.12 -39.03 79.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.908 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -67.62 -39.56 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.33 -48.62 40.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.66 -35.92 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 93.5 m -70.67 -47.35 60.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -53.76 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -61.82 -48.63 79.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 28.0 mt -57.86 -35.06 70.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.921 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.936 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.804 0.335 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.74 -55.13 36.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.31 -38.29 73.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.03 -51.66 67.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -30.72 61.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.959 HG22 HD23 ' A' ' 82' ' ' LEU . 91.4 m -59.25 -22.08 60.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.169 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.01 -34.52 13.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.88 -27.15 20.11 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.469 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.959 HD23 HG22 ' A' ' 79' ' ' THR . 2.0 pp -48.31 -35.65 12.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.801 0.334 . . . . 0.0 110.893 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -50.22 74.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.13 -43.81 98.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.41 -49.28 74.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.63 -41.58 86.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -58.62 -50.6 73.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.837 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.83 -45.08 90.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.16 -46.84 79.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.23 -50.39 73.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.78 -48.27 69.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.68 -35.57 81.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.886 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 89' ' ' ASP . 63.2 t -65.62 -32.29 57.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.162 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.39 -52.77 11.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.73 -33.27 73.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.088 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -78.03 -33.15 51.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.82 -42.68 86.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.178 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 mt-30 -44.6 -64.89 0.71 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.592 0.71 . . . . 0.0 110.918 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.8 -32.9 17.52 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.717 2.278 . . . . 0.0 112.317 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.413 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 15.7 t80 -59.11 -25.22 63.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.1 -50.88 20.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.8 -32.52 73.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.896 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -47.4 65.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.913 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -56.09 -52.41 64.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.23 -47.54 76.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -61.0 -22.75 64.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.919 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -74.32 -45.98 43.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -30.53 71.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -66.18 -55.88 14.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -69.65 -34.46 74.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.94 -31.73 68.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.03 -54.24 16.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.897 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.51 -35.13 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.62 -25.91 54.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.786 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -65.25 -54.62 26.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -41.31 65.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.403 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 39.3 tt0 -62.01 -25.81 67.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -84.81 -39.23 18.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 115' ' ' TYR . 84.9 t -59.45 -32.49 48.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.157 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.541 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 4.7 mt-10 -57.61 -64.78 2.28 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.645 0.736 . . . . 0.0 110.921 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.8 Cg_endo -69.74 -51.14 0.4 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.699 2.266 . . . . 0.0 112.356 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.2 tp -67.27 -64.3 0.88 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.23 -32.67 3.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.451 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -74.36 -43.84 54.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -70.89 -35.49 72.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -49.96 64.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -68.12 -37.13 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.879 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -71.24 -53.57 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -61.44 -37.05 82.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.848 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.577 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -63.77 -40.22 96.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.113 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.401 ' HG3' ' CH2' ' B' ' 108' ' ' TRP . 0.0 OUTLIER -63.02 -49.65 73.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.99 -32.39 69.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -69.82 -50.87 38.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.4 p -67.09 -41.55 87.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.131 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.46 ' N ' HG13 ' A' ' 156' ' ' VAL . 6.3 t70 -53.33 -52.63 58.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.31 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.109 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 163' ' ' LEU . 2.1 mp -56.77 -45.3 82.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -63.31 -44.09 95.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.882 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 32.2 m -56.09 -40.78 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.41 -31.23 33.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 159' ' ' LEU . 1.8 mm? -69.34 -22.27 63.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.899 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.812 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.97 -62.7 3.81 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.549 0.69 . . . . 0.0 111.114 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.812 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.83 -45.85 1.4 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.67 2.247 . . . . 0.0 112.347 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.55 -29.13 64.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -52.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.836 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.86 -33.18 75.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.839 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.71 -51.91 30.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.846 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.29 -49.34 64.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.88 -35.95 69.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.87 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -41.9 82.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -72.31 -40.52 67.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.865 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -50.56 38.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.928 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.62 -40.96 80.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.092 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.1 -41.83 61.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.099 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -65.72 -34.15 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.558 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -69.54 -50.07 48.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . 0.558 ' N ' HD23 ' A' ' 178' ' ' LEU . 77.1 mt-10 -69.4 -35.57 75.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.13 -49.17 53.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.125 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.9 -43.15 81.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -70.28 -30.86 67.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.881 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -55.48 31.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.85 -26.79 68.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.74 -34.47 44.39 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.69 -33.3 41.61 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.498 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.39 42.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.32 . . . . 0.0 111.092 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -73.1 -32.67 65.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -39.49 93.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.958 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.38 35.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.08 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -49.56 75.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -57.99 -44.24 87.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -53.64 -49.37 68.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.878 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.41 -31.3 70.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.096 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -49.6 16.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.57 -34.7 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.114 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . 0.602 HG21 HD22 ' B' ' 240' ' ' LEU . 86.1 m -65.76 -47.57 74.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.148 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.44 -36.16 76.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.91 -46.44 87.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.837 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -30.13 64.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.03 -51.11 70.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.813 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.64 -50.59 50.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.32 -55.07 32.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.913 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 68.1 m -54.23 -36.03 63.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.84 -46.53 87.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -29.83 52.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.38 -21.89 64.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.506 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 2.1 mttt -60.93 -63.08 4.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.562 0.696 . . . . 0.0 110.921 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.2 Cg_endo -69.78 -26.82 27.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.355 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.04 57.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 211' ' ' LEU . 2.8 tm? -72.07 -37.18 69.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.25 -50.85 66.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -31.06 57.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.838 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.44 -50.93 70.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . 0.426 ' HD3' HD21 ' A' ' 211' ' ' LEU . 0.0 OUTLIER -68.37 -35.84 78.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -57.06 -48.94 77.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.49 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.97 -29.78 72.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.459 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -32.66 74.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.85 0.357 . . . . 0.0 110.891 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.475 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -52.34 -61.67 4.23 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.3 Cg_endo -69.8 -43.85 2.38 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.28 . . . . 0.0 112.332 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 217' ' ' GLY . 54.1 t -57.27 -55.2 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.128 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.65 -33.25 71.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.955 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.631 ' O ' HG23 ' A' ' 227' ' ' VAL . 5.0 mt-10 -68.56 -34.86 76.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 70.6 m -59.96 -47.87 84.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -66.01 -41.93 90.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -45.13 87.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.93 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 223' ' ' GLU . 44.3 t -55.38 -42.82 69.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.152 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -49.94 75.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.841 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -64.78 -37.59 88.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.861 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.596 HD13 HD11 ' A' ' 233' ' ' LEU . 1.6 mm? -64.93 -34.52 78.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.08 -30.48 65.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.02 -50.84 53.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.109 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.596 HD11 HD13 ' A' ' 230' ' ' LEU . 1.4 pp -67.43 -35.57 79.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -39.51 69.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.91 -49.2 31.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -57.71 -41.44 81.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.966 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 80.5 m -65.8 -45.56 81.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.118 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.74 53.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 10.8 mtmm -57.78 -49.55 76.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.926 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.607 HD22 HG21 ' B' ' 197' ' ' THR . 0.5 OUTLIER -58.36 -35.11 71.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.904 0.383 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.77 -55.16 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.28 -38.3 73.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -51.5 67.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.908 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . 0.989 HG22 HD23 ' B' ' 82' ' ' LEU . 93.9 m -59.23 -21.96 60.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.141 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.24 -34.46 15.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.98 -27.15 20.96 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.509 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.989 HD23 HG22 ' B' ' 79' ' ' THR . 2.0 pp -48.39 -35.44 12.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 110.903 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -50.23 74.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -43.82 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.902 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.34 -49.33 74.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.74 -41.34 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.93 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -58.72 -50.48 73.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.92 -45.42 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.706 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -55.76 -47.04 77.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -50.21 73.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -48.12 70.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.866 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.81 -35.6 81.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.841 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 89' ' ' ASP . 67.9 t -65.68 -32.34 57.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.83 -53.07 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.893 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 -34.65 74.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.074 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -77.96 -33.48 51.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.909 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.94 -45.68 80.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.105 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.566 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.9 mt-30 -43.68 -66.16 0.49 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.566 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.8 -32.48 18.34 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.33 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . 0.419 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.0 t80 -58.76 -24.27 61.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.41 -50.07 15.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -59.87 -32.51 70.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.22 -47.11 62.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -55.84 -53.1 60.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.48 -47.66 78.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -60.87 -22.38 64.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -73.51 -47.54 40.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.401 ' CH2' ' HG3' ' A' ' 153' ' ' ARG . 0.1 OUTLIER -63.78 -31.81 73.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -64.03 -56.15 17.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.909 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -70.47 -34.26 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.73 -32.43 69.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -54.21 15.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.841 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.97 -35.6 81.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.67 -25.65 53.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.935 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.6 t80 -65.16 -54.84 23.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.13 -37.72 66.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -65.62 -24.35 67.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.923 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -88.02 -40.11 14.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 94.5 t -60.11 -32.75 51.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.153 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 4.7 mt-10 -58.45 -64.52 2.74 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.667 0.746 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.8 Cg_endo -69.78 -50.68 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.661 2.241 . . . . 0.0 112.304 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.21 -64.84 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 149' ' ' ARG . . . -45.39 -31.02 3.21 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.467 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -76.51 -44.52 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 110.918 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -70.44 -42.41 71.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 15.8 mmt -65.07 -53.35 47.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.885 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' B' ' 145' ' ' GLY . 1.6 tmm_? -61.16 -42.34 98.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.839 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -66.43 -51.87 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.79 -32.05 71.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.671 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.17 -47.52 76.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.085 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -45.32 91.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.33 -33.67 67.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.077 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -69.68 -50.19 46.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.671 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.8 p -65.14 -41.56 92.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . 0.428 ' N ' HG13 ' B' ' 156' ' ' VAL . 6.1 t70 -53.67 -52.06 61.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.45 75.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.436 ' O ' HD23 ' B' ' 163' ' ' LEU . 2.7 mp -56.92 -43.38 81.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.91 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -63.46 -44.37 94.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 25.1 m -56.25 -41.39 75.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.148 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -31.13 39.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.436 HD23 ' O ' ' B' ' 159' ' ' LEU . 1.8 mm? -70.13 -22.37 63.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.844 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.89 -62.86 3.53 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.579 0.704 . . . . 0.0 111.151 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.3 Cg_endo -69.76 -44.34 2.13 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.675 2.25 . . . . 0.0 112.337 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -58.66 -29.91 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.9 67.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.83 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.48 -33.51 76.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.73 -51.89 30.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 20.5 tp -67.18 -49.34 65.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.921 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.96 -36.22 70.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.6 83.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -72.38 -40.75 67.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.18 -50.35 41.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.974 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.79 -40.73 80.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.21 -41.31 61.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.075 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -66.16 -34.01 77.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.864 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.56 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.2 tt -69.62 -49.72 51.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.933 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . 0.56 ' N ' HD23 ' B' ' 178' ' ' LEU . 77.0 mt-10 -69.27 -36.42 77.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.906 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -69.68 -49.14 56.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 2.2 tt -57.55 -41.81 81.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -71.73 -31.42 66.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.44 -55.27 33.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.862 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.55 -26.8 68.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.73 -34.58 44.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.462 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.52 -33.37 40.52 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.47 42.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.75 0.309 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -73.02 -32.62 65.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -39.63 93.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.22 36.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -49.5 75.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.04 -44.37 87.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.919 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -53.5 -49.39 67.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.29 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -49.65 16.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.59 -34.68 78.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . 0.607 HG21 HD22 ' A' ' 240' ' ' LEU . 85.4 m -65.68 -47.56 75.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.113 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.49 -36.23 76.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.85 -46.39 87.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -30.16 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.01 -51.02 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.61 -50.61 50.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.37 -55.08 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 68.0 m -54.24 -36.06 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.86 -46.51 87.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -30.02 52.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.76 64.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.1 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.513 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 2.1 mttt -61.01 -63.23 4.57 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.586 0.708 . . . . 0.0 110.865 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.77 -26.8 27.15 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 0.0 112.31 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -31.98 57.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . 0.488 ' C ' HD13 ' B' ' 211' ' ' LEU . 2.7 tm? -72.02 -37.18 69.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.13 -50.85 65.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.865 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.32 -31.16 58.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.32 -50.97 70.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.9 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . 0.43 ' HD3' HD21 ' B' ' 211' ' ' LEU . 0.0 OUTLIER -68.4 -35.9 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.869 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.07 -48.91 77.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.96 -29.78 72.4 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.494 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.18 -32.63 74.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 0.0 110.908 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.9 OUTLIER -52.39 -61.7 4.21 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.612 0.72 . . . . 0.0 110.885 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.69 -43.96 2.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.719 2.279 . . . . 0.0 112.364 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 217' ' ' GLY . 57.1 t -57.24 -55.15 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.109 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.72 -33.23 71.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.635 ' O ' HG23 ' B' ' 227' ' ' VAL . 5.0 mt-10 -68.49 -34.84 76.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 70.7 m -60.02 -47.85 84.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -65.84 -42.16 90.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -44.93 88.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.889 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.635 HG23 ' O ' ' B' ' 223' ' ' GLU . 42.9 t -55.46 -42.86 69.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.159 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.22 -49.96 75.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -64.69 -37.7 88.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.899 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.584 HD13 HD11 ' B' ' 233' ' ' LEU . 1.6 mm? -64.86 -34.5 78.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.943 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.1 -30.51 65.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.96 -50.86 53.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.584 HD11 HD13 ' B' ' 230' ' ' LEU . 1.4 pp -67.41 -35.64 79.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.0 -39.61 69.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.81 -49.15 32.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.897 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -57.79 -41.45 82.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.908 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 81.3 m -65.77 -45.53 82.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.76 53.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 10.7 mtmm -57.82 -49.51 76.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.602 HD22 HG21 ' A' ' 197' ' ' THR . 0.5 OUTLIER -58.48 -35.02 71.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.885 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.865 0.364 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.07 -55.25 27.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.53 -38.7 81.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.941 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.07 -50.94 69.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.21 -32.62 61.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.872 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.9 m -65.92 -23.92 66.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.47 -33.66 22.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.98 -30.73 54.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.487 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.678 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.9 tm? -51.73 -36.31 46.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.807 0.336 . . . . 0.0 110.932 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -49.79 75.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -41.3 96.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -48.34 81.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -40.05 96.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -50.6 73.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.78 -46.01 91.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.92 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.717 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.2 t70 -56.1 -47.59 77.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -51.47 69.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -47.8 65.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.26 -38.41 91.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 89' ' ' ASP . 88.7 t -65.0 -31.75 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -74.96 -54.26 7.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.2 -30.16 70.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.156 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -79.0 -36.64 40.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.03 -45.0 83.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.122 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.552 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.3 mm-40 -43.84 -65.43 0.59 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.578 0.704 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.552 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 54.0 Cg_endo -69.76 -25.63 28.38 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.639 2.226 . . . . 0.0 112.367 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -53.56 -58.14 8.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -54.92 -28.57 51.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.02 -47.62 73.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -44.19 87.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.863 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -50.52 72.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.89 -47.35 86.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -60.93 -26.24 67.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.927 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -45.27 62.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.895 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . 0.55 ' HE1' ' NH1' ' B' ' 149' ' ' ARG . 0.0 OUTLIER -69.96 -23.3 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -68.12 -64.48 0.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -62.94 -34.97 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.64 -30.32 66.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.924 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 45.3 ttp -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.9 -41.31 97.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -24.79 55.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.958 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.767 ' O ' HG23 ' A' ' 119' ' ' VAL . 6.6 t80 -63.66 -55.05 26.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -69.95 -42.72 72.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.33 -26.61 67.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.876 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -89.63 -37.81 14.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 115' ' ' TYR . 50.8 t -58.47 -31.73 43.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -60.91 -64.78 2.71 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.67 0.748 . . . . 0.0 110.903 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.75 -51.03 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.677 2.251 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.9 -63.48 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.11 -30.72 1.9 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.524 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.32 -43.72 60.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.859 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -74.95 -33.92 61.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -48.65 68.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.4 ' NH1' ' HE1' ' B' ' 108' ' ' TRP . 0.9 OUTLIER -69.21 -37.15 77.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -71.0 -50.82 30.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.7 -37.97 89.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.13 -43.51 98.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -62.18 -50.62 71.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.29 -30.29 69.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.118 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 35.7 t60 -68.36 -50.44 53.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.848 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.9 p -66.65 -37.26 79.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.161 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -57.2 -52.94 63.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.91 -49.15 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.549 ' O ' HD23 ' A' ' 163' ' ' LEU . 6.2 mt -56.43 -49.57 74.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.47 ' HB3' HD22 ' B' ' 101' ' ' LEU . 23.5 mmt-85 -60.17 -39.4 86.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 95.0 m -57.3 -48.04 79.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -76.14 -35.14 59.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.64 62.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.19 -62.43 5.98 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 0.0 111.133 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.8 -41.37 4.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.73 2.286 . . . . 0.0 112.323 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -61.57 -34.73 76.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.6 t -60.99 -45.76 93.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -62.56 -50.92 69.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.859 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.32 -51.43 69.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.551 ' C ' HD13 ' A' ' 170' ' ' LEU . 1.7 tm? -63.25 -46.57 86.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . 0.405 ' HG3' HD11 ' B' ' 90' ' ' LEU . 1.8 tpt85 -60.39 -38.09 82.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -34.65 78.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.14 -49.0 60.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.77 -50.92 30.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.945 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.2 -45.84 72.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.35 -36.03 71.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -32.35 72.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.415 ' O ' HD12 ' A' ' 178' ' ' LEU . 4.8 tp -72.26 -50.88 23.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.48 -45.0 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.69 93.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 55.4 tp -58.81 -40.87 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -66.26 -31.82 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -55.3 33.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -65.74 -26.23 67.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.19 -33.66 38.55 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.502 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.23 -32.7 37.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.507 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.22 42.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.738 0.304 . . . . 0.0 111.078 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -72.91 -34.36 66.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.882 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.67 86.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.58 36.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.01 -48.77 77.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.892 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.27 -43.93 92.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' ' 197' ' ' THR . 85.1 t60 -53.27 -50.58 64.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.851 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.15 69.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -49.31 18.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.55 -36.72 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.081 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 193' ' ' HIS . 21.1 p -63.17 -47.58 82.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.148 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -35.96 80.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.55 -45.95 87.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.64 -30.24 65.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.943 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -50.9 71.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 54.3 m -68.18 -50.15 56.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.11 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.58 -54.05 46.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 67.0 m -54.59 -36.14 64.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.61 -47.78 83.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.905 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.2 -28.07 48.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.845 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.16 -22.08 63.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.152 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.494 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -60.22 -62.59 5.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.577 0.703 . . . . 0.0 110.908 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.494 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.81 -27.11 26.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.274 . . . . 0.0 112.354 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.82 -30.94 56.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.126 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.99 -37.52 66.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.879 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.06 -50.81 65.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.885 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.01 -30.71 61.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -51.35 70.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -37.18 81.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.73 -49.09 76.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.483 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.19 -29.42 73.3 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -62.98 -32.93 74.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 110.928 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -52.17 -61.77 4.03 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.583 0.706 . . . . 0.0 110.935 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.72 -43.74 2.52 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.703 2.269 . . . . 0.0 112.338 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 217' ' ' GLY . 52.9 t -57.26 -53.69 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.182 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.63 -33.52 71.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 227' ' ' VAL . 1.8 tt0 -65.0 -36.0 82.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 47.7 t -61.84 -48.32 81.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.13 -41.06 82.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.919 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.76 -45.44 86.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.929 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 223' ' ' GLU . 28.9 t -56.8 -41.57 75.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.148 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.96 -50.12 75.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.05 -38.08 84.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.403 ' HA ' HD21 ' A' ' 233' ' ' LEU . 0.4 OUTLIER -62.09 -35.87 79.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.48 -30.53 67.36 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.84 -51.29 57.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 230' ' ' LEU . 0.8 OUTLIER -70.12 -41.05 74.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.29 -43.4 98.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.28 -47.57 76.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.85 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -53.99 -39.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 13.0 m -67.04 -44.8 79.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.11 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -55.5 33.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.31 -49.07 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -57.84 -39.81 78.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.859 179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 52.7 t30 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.893 0.378 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.2 tp -63.14 -55.26 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.92 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.52 -38.71 81.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.04 -50.96 69.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.947 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -75.18 -32.69 61.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.885 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -65.77 -23.91 66.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.4 -33.63 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.95 -30.79 54.66 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.669 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.7 tm? -51.68 -36.42 46.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.8 0.333 . . . . 0.0 110.931 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -49.78 75.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.825 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -41.49 97.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -48.61 80.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -40.22 96.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -50.4 73.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.49 -46.73 88.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.721 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.1 t70 -55.85 -47.91 76.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.9 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.405 HD11 ' HG3' ' A' ' 171' ' ' ARG . 0.4 OUTLIER -57.8 -51.57 69.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.86 -47.96 64.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.45 -37.31 86.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 89' ' ' ASP . 88.6 t -65.7 -32.03 56.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.163 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -75.08 -55.49 5.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.945 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.98 -31.75 70.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.068 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt -78.78 -37.44 41.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.6 t -51.79 -51.6 26.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.576 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mm-40 -39.88 -67.27 0.29 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 110.895 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.576 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.76 -20.65 34.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 0.0 112.37 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.48 -55.55 24.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 160' ' ' ARG . 1.4 pp -62.24 -28.39 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.969 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -49.23 78.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.07 -43.84 77.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.814 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.25 -50.81 71.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.844 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.7 -47.71 84.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -59.53 -25.41 64.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.39 -47.34 50.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.962 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . 0.4 ' HE1' ' NH1' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -66.56 -25.92 66.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 179.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -67.51 -65.58 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -60.97 -35.65 77.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.41 -29.9 66.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.886 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 39.3 ttp -65.63 -51.13 61.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.06 -41.27 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mp -75.83 -24.65 55.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.732 ' O ' HG23 ' B' ' 119' ' ' VAL . 8.4 t80 -63.74 -55.09 25.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -71.14 -39.55 71.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -25.67 68.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -91.8 -39.11 11.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.732 HG23 ' O ' ' B' ' 115' ' ' TYR . 45.0 t -58.85 -31.29 44.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.148 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.531 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -61.58 -64.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.662 0.744 . . . . 0.0 110.889 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.531 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.76 -50.61 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -63.82 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.63 -30.35 1.46 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.502 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.61 -45.0 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.815 0.34 . . . . 0.0 110.907 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -74.56 -35.78 63.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.37 47.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.55 ' NH1' ' HE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -65.57 -36.83 84.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.876 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.47 -50.72 50.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 2.8 ttp85 -64.14 -34.44 78.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.38 70.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -56.67 -50.04 73.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.97 70.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.11 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -68.75 -49.98 54.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.03 -36.76 78.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.71 -52.06 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.47 -49.51 68.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.556 ' O ' HD23 ' B' ' 163' ' ' LEU . 6.2 mt -56.8 -48.03 78.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.82 -40.12 91.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 92.5 m -57.47 -46.69 83.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.141 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -76.49 -35.73 58.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.76 62.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.78 -62.17 6.5 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.571 0.7 . . . . 0.0 111.108 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.6 Cg_endo -69.79 -42.24 3.54 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.663 2.242 . . . . 0.0 112.336 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -60.81 -33.55 73.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.4 t -61.49 -46.22 90.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.821 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -62.41 -48.9 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.96 -51.87 67.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 11.3 tp -61.2 -49.19 78.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -62.31 -34.56 76.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.7 -34.77 79.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -47.11 57.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.0 tp -70.17 -51.12 33.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.08 -45.12 75.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.3 -34.81 70.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.125 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -32.5 71.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.886 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.421 ' O ' HD12 ' B' ' 178' ' ' LEU . 4.9 tp -71.76 -50.22 31.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -67.35 -43.21 82.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.893 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.39 90.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.079 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 54.9 tp -60.03 -38.28 82.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -69.67 -32.22 70.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -55.13 35.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.885 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.62 -26.15 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.14 -33.75 38.36 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.481 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.12 -32.8 36.38 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.502 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.17 42.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.116 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -73.03 -34.29 66.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.836 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -37.71 87.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.02 -49.39 37.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.119 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.06 -48.7 77.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.42 -43.77 92.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.892 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 197' ' ' THR . 85.0 t60 -53.46 -50.42 65.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.851 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.03 -31.17 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.082 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.63 -49.24 19.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.79 83.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.091 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . 0.481 HG23 ' O ' ' B' ' 193' ' ' HIS . 21.2 p -63.12 -47.45 82.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.168 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -35.94 80.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.87 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.65 -45.89 88.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.844 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.62 -30.28 65.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -50.94 71.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.836 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 54.1 m -68.14 -50.07 57.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.164 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.64 -53.93 48.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.953 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 66.7 m -54.75 -36.07 64.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.868 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.67 -47.77 83.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.17 -28.03 48.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.9 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.12 63.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.503 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -60.13 -62.66 5.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.524 0.678 . . . . 0.0 110.927 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.3 Cg_endo -69.81 -27.06 26.72 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.666 2.244 . . . . 0.0 112.338 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.92 -30.88 56.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.094 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.08 -37.41 66.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -53.89 -50.81 65.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -30.92 61.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.65 -51.57 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.898 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -37.57 82.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.68 -49.07 76.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.496 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.88 -29.51 73.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.49 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.03 -32.79 74.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.939 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.3 mp -52.18 -61.74 4.07 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.609 0.719 . . . . 0.0 110.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.77 -43.69 2.5 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.671 2.247 . . . . 0.0 112.325 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 217' ' ' GLY . 54.6 t -57.27 -53.86 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.106 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.5 -33.55 71.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.566 ' O ' HG23 ' B' ' 227' ' ' VAL . 1.8 tt0 -64.93 -35.91 82.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.889 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 47.8 t -61.97 -48.3 80.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -68.13 -41.07 82.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.8 -45.49 86.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.887 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 223' ' ' GLU . 27.3 t -56.71 -41.65 75.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.105 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.02 -50.07 75.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.828 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -38.15 85.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' B' ' 233' ' ' LEU . 0.4 OUTLIER -62.07 -35.85 79.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.47 -30.53 67.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.83 -51.41 55.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.09 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' B' ' 230' ' ' LEU . 0.8 OUTLIER -69.94 -41.15 74.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.26 -43.55 97.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.866 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.22 -47.51 76.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -54.03 -39.2 65.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.92 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 12.9 m -66.96 -44.68 79.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.164 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -55.6 31.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.874 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.2 -49.08 78.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.551 HD13 ' O ' ' B' ' 240' ' ' LEU . 0.4 OUTLIER -57.83 -39.78 78.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.9 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 52.8 t30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.783 ' O ' HG23 ' A' ' 79' ' ' THR . 9.3 tp -62.33 -55.4 28.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.26 -33.28 75.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -44.37 81.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.17 -37.48 63.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 75' ' ' LEU . 36.3 p -61.84 -21.04 64.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.099 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.09 -31.7 8.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.82 -29.85 43.01 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.466 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 82' ' ' LEU . 2.0 tm? -51.17 -35.25 35.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.845 0.355 . . . . 0.0 110.947 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -50.1 74.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.92 -40.87 95.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -47.41 85.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -40.79 98.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.86 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.409 ' HA ' HD12 ' A' ' 90' ' ' LEU . 2.9 m -58.32 -50.68 72.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.866 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -45.27 95.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.92 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.718 ' O ' HG23 ' A' ' 93' ' ' VAL . 1.0 OUTLIER -56.52 -48.01 78.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 87' ' ' SER . 8.8 mt -57.5 -51.61 68.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.15 -47.86 65.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -63.74 -36.8 85.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.852 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.718 HG23 ' O ' ' A' ' 89' ' ' ASP . 77.6 t -65.8 -32.11 56.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.087 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -74.94 -54.28 7.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.39 71.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.118 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.89 -35.94 42.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.56 -44.79 85.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.118 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.548 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.4 mt-30 -43.81 -65.18 0.62 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.584 0.707 . . . . 0.0 110.894 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.3 Cg_endo -69.71 -26.22 28.02 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.341 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -52.93 -58.48 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' B' ' 160' ' ' ARG . 1.3 pp -54.83 -27.84 45.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -43.81 85.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.87 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -71.97 -37.26 69.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.68 -53.23 58.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.894 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -42.86 98.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -62.56 -28.05 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.89 -45.79 60.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -24.01 64.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -66.75 -65.22 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.62 -35.47 77.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -71.1 -29.77 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -64.42 -51.29 63.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.883 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.48 -41.02 98.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.69 -24.12 56.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 119' ' ' VAL . 7.5 t80 -63.68 -55.76 20.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -63.44 -24.88 68.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.892 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -92.73 -32.99 14.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 115' ' ' TYR . 42.6 t -62.6 -32.07 54.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.158 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 9.4 tt0 -63.28 -61.7 6.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.3 Cg_endo -69.77 -51.21 0.4 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.702 2.268 . . . . 0.0 112.329 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.68 -62.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.937 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.72 -30.72 1.61 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.474 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.79 -43.73 53.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.804 0.335 . . . . 0.0 110.855 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -37.4 64.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -48.99 67.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.9 tpp85 -67.77 -38.4 83.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.868 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -70.42 -50.87 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -38.06 89.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.839 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -62.53 -43.74 98.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.058 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -60.96 -51.25 70.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.857 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.02 -29.97 69.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.117 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -67.85 -51.07 52.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 152' ' ' ALA . 8.2 p -65.84 -39.47 84.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.141 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.61 -52.56 61.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.82 -48.3 74.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.108 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -42.57 78.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.514 ' HB3' HD13 ' B' ' 101' ' ' LEU . 1.5 mpt_? -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.832 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.8 -47.49 82.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.112 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -78.83 -35.51 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.8 tt -71.68 -15.4 62.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.25 -62.69 5.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 0.0 111.142 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.76 -40.81 4.89 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . 0.48 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 14.4 t80 -61.92 -34.64 76.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -61.27 -46.19 91.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.874 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.54 -48.95 78.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.889 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.08 -52.01 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.48 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 12.4 tp -59.58 -50.14 75.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . 0.528 HH21 HG11 ' B' ' 93' ' ' VAL . 7.2 mmm180 -63.71 -34.38 77.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.9 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -35.38 79.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.19 -50.82 24.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.96 -51.72 56.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.916 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.91 -44.83 74.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.061 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.71 -35.09 70.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -65.84 -33.1 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 178' ' ' LEU . 1.4 tp -73.8 -51.06 17.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.74 -50.33 65.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.83 -47.74 79.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.119 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 59.1 tp -56.81 -40.03 75.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -65.94 -32.73 74.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -55.0 37.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -67.78 -26.13 65.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.9 -33.95 36.93 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.491 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.86 36.17 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.462 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.76 43.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.766 0.317 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -73.27 -35.89 66.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.29 -37.44 85.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.96 -49.01 41.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.164 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -50.75 71.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.91 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.12 -42.22 85.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -53.95 -49.49 68.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.12 70.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.56 -49.91 17.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.26 79.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . 0.93 HG23 HD13 ' B' ' 240' ' ' LEU . 59.3 m -64.21 -47.79 78.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.147 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -36.74 80.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.857 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -58.93 -43.8 91.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.34 -31.02 65.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -50.94 71.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 23.1 p -67.72 -50.41 57.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.113 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.59 -52.69 61.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 27.5 t -55.23 -35.84 65.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.848 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.87 -48.07 82.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -29.18 50.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.43 -21.55 63.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.111 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.497 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 1.8 mtpp -59.86 -62.54 5.69 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.615 0.722 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.71 -27.26 26.92 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 0.0 112.343 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.5 -31.85 57.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.121 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.495 ' C ' HD13 ' A' ' 211' ' ' LEU . 3.0 tm? -72.8 -37.46 67.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.85 -51.33 63.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.78 61.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.97 -50.8 70.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.945 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.23 -37.48 85.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.829 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -56.52 -48.31 77.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.926 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.538 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.81 -28.39 73.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.508 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 23.3 tp -66.07 -33.33 75.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.83 0.348 . . . . 0.0 110.931 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.9 tp -49.98 -60.13 5.69 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 0.0 110.911 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.1 Cg_endo -69.77 -39.56 6.34 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.692 2.261 . . . . 0.0 112.345 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.7 t -58.35 -54.49 32.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.02 -34.88 73.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 227' ' ' VAL . 10.2 tt0 -64.85 -35.17 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.882 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.03 -48.54 79.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.85 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -40.76 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.862 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.21 -47.7 78.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 223' ' ' GLU . 37.7 t -56.79 -40.17 69.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.153 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.64 -50.18 74.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -61.34 -38.65 87.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.885 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.774 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -63.43 -35.28 79.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.896 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 8.8 m -69.9 -30.15 67.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.9 -50.96 45.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.11 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.774 HD11 HD13 ' A' ' 230' ' ' LEU . 1.0 OUTLIER -69.25 -42.05 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.0 -38.82 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.66 -47.3 63.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . 0.699 ' CZ ' HD11 ' A' ' 240' ' ' LEU . 11.1 t80 -54.07 -39.23 66.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.892 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' O ' ' A' ' 233' ' ' LEU . 36.5 p -69.27 -45.63 69.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.149 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.41 -54.3 42.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.92 -36.3 81.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.877 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.939 HD13 HG23 ' B' ' 197' ' ' THR . 9.5 mt -57.57 -40.94 80.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.777 ' O ' HG23 ' B' ' 79' ' ' THR . 9.3 tp -62.2 -55.42 28.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -33.29 75.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.887 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.909 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.09 -37.94 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . 0.777 HG23 ' O ' ' B' ' 75' ' ' LEU . 36.8 p -61.33 -20.94 63.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.108 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.08 -31.8 8.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.74 -29.9 42.45 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.682 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.9 tm? -51.17 -35.33 35.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 110.945 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -50.12 74.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.79 -40.95 96.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.02 -47.73 84.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -40.56 98.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . 0.412 ' HA ' HD12 ' B' ' 90' ' ' LEU . 2.9 m -58.24 -50.52 73.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -45.47 93.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.882 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.41 -48.27 77.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.896 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' B' ' 87' ' ' SER . 8.0 mt -57.38 -51.6 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.86 -47.87 64.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -64.14 -36.08 82.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.3 t -66.44 -32.16 56.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 2.2 tmtt? -75.28 -55.27 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.73 70.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.135 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -78.85 -36.68 41.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.5 t -52.76 -50.59 41.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.573 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mt-30 -40.77 -66.75 0.35 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.533 0.682 . . . . 0.0 110.926 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.9 Cg_endo -69.78 -21.72 33.0 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.675 2.25 . . . . 0.0 112.349 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -52.89 -56.14 18.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.875 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.514 HD13 ' HB3' ' A' ' 160' ' ' ARG . 1.2 pp -61.19 -28.19 68.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.907 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -45.9 90.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.844 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -73.09 -38.0 66.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.09 -53.5 56.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.874 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -42.66 99.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.873 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -61.84 -26.99 68.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -72.79 -47.94 42.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -26.67 68.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.24 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.11 -35.52 77.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -71.22 -29.46 65.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -64.44 -50.67 66.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -64.19 -40.22 95.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.26 -24.76 57.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.739 ' O ' HG23 ' B' ' 119' ' ' VAL . 18.1 t80 -65.18 -55.66 17.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.916 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -39.47 83.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -66.2 -24.95 66.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -92.24 -37.79 12.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.923 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.739 HG23 ' O ' ' B' ' 115' ' ' TYR . 52.1 t -60.4 -31.86 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.125 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.516 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.4 mt-10 -61.85 -63.86 3.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 0.0 110.872 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.73 -50.39 0.47 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.276 . . . . 0.0 112.363 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -63.89 1.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.99 -30.16 1.67 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.5 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.31 -44.34 37.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.866 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -44.36 61.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.859 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -51.78 62.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -61.62 -42.04 98.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.68 -50.49 62.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -33.78 75.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.63 -50.75 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.074 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -55.98 -50.34 71.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.881 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.66 -30.87 70.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.109 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -67.92 -50.63 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.35 -39.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -54.66 -52.28 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.97 -48.27 74.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.062 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.76 -42.38 79.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . 0.468 ' HB3' HD13 ' A' ' 101' ' ' LEU . 7.7 mpt_? -66.41 -39.18 88.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.79 -47.29 82.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.155 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -79.03 -35.35 42.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.829 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.9 tt -71.76 -15.93 62.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.887 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.65 -62.66 5.52 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.605 0.717 . . . . 0.0 111.122 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.75 -40.15 5.67 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 0.0 112.356 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . 0.413 ' CZ ' HD22 ' B' ' 170' ' ' LEU . 14.4 t80 -62.71 -34.32 76.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.892 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -61.35 -46.45 90.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.86 -48.16 81.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.44 -51.86 63.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' B' ' 166' ' ' TYR . 12.4 tp -60.08 -49.56 77.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . 0.414 HH21 HG11 ' A' ' 93' ' ' VAL . 7.2 mmm180 -63.89 -34.29 77.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.76 -35.73 80.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.03 -50.82 25.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -51.58 58.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.25 -44.31 75.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.113 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.82 -35.05 69.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -65.25 -33.86 77.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.431 ' O ' HD12 ' B' ' 178' ' ' LEU . 1.5 tp -73.52 -50.53 20.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.925 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.32 -47.55 76.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -60.04 -48.74 80.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 57.9 tp -57.3 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -70.36 -33.7 71.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -54.16 47.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.846 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -67.95 -25.95 65.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.85 -33.87 36.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.516 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.03 -32.19 34.45 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.46 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.32 -25.51 42.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.327 . . . . 0.0 111.102 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 8.3 ttp180 -73.01 -36.81 67.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.897 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -37.26 83.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.935 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.91 -48.82 42.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.094 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -51.29 69.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -57.91 -42.48 84.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -53.52 -49.67 67.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.85 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.29 -31.05 70.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -75.51 -49.87 17.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.909 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.39 -35.44 79.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.118 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . 0.939 HG23 HD13 ' A' ' 240' ' ' LEU . 56.5 m -64.02 -47.72 79.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -36.76 80.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.892 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -58.97 -43.57 91.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.51 -31.05 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -50.87 71.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 23.2 p -67.66 -50.41 57.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 26.7 tp -54.68 -52.65 61.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.882 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 27.7 t -55.25 -35.79 65.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.839 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.96 -48.04 82.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.87 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.18 50.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.58 -21.41 63.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 1.8 mtpp -59.98 -62.53 5.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.555 0.693 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.5 Cg_endo -69.78 -27.24 26.61 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.686 2.257 . . . . 0.0 112.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.58 -31.87 57.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' B' ' 211' ' ' LEU . 3.0 tm? -72.66 -37.5 67.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.94 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.88 -51.17 64.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.77 61.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.81 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -62.09 -50.85 70.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.15 -37.49 85.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.842 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -56.45 -48.37 77.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.563 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.76 -28.37 73.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.494 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 23.4 tp -66.12 -33.32 75.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.9 tp -50.07 -60.03 5.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.598 0.713 . . . . 0.0 110.918 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.9 Cg_endo -69.76 -39.63 6.28 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.662 2.241 . . . . 0.0 112.369 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.36 -54.51 31.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.161 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.01 -34.87 73.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.536 ' O ' HG23 ' B' ' 227' ' ' VAL . 10.2 tt0 -64.9 -35.11 80.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.863 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.09 -48.52 79.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.854 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -40.87 76.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.927 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.16 -47.75 78.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.902 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.536 HG23 ' O ' ' B' ' 223' ' ' GLU . 37.7 t -56.74 -40.21 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.136 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.18 74.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -61.35 -38.6 87.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.785 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -63.38 -35.45 80.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 8.6 m -69.78 -30.22 67.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.86 45.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.122 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.785 HD11 HD13 ' B' ' 230' ' ' LEU . 1.0 OUTLIER -69.28 -42.12 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -38.73 92.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.892 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.71 -47.26 63.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . 0.689 ' CZ ' HD11 ' B' ' 240' ' ' LEU . 11.3 t80 -54.17 -39.13 66.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . 0.717 HG23 ' O ' ' B' ' 233' ' ' LEU . 35.9 p -69.32 -45.63 69.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.135 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -54.47 -54.24 43.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.84 -36.35 82.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.931 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.93 HD13 HG23 ' A' ' 197' ' ' THR . 9.4 mt -57.52 -40.89 79.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.94 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.881 0.372 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.5 -57.04 10.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.12 -33.79 58.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.63 -52.85 55.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -27.83 65.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.0 m -58.61 -26.9 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -50.87 -47.44 60.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.93 -29.26 19.52 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.514 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.1 tm? -49.83 -43.21 48.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 0.0 110.933 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.9 ttt180 -58.03 -49.42 76.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.79 88.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.897 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.26 -49.95 72.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -42.54 81.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.77 -50.5 73.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.838 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -43.56 89.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -57.16 -48.49 78.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.2 tp -57.01 -49.87 74.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.28 -48.0 71.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.43 -35.98 82.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 64.9 t -65.39 -32.83 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.092 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -74.5 -52.63 11.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.76 -32.58 72.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -77.98 -33.57 51.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -58.98 -43.29 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.537 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.4 OUTLIER -43.95 -64.93 0.67 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.59 0.709 . . . . 0.0 110.911 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.69 -30.31 22.81 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 0.0 112.371 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -58.25 -27.44 63.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -50.71 28.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -33.79 76.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.48 -48.12 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.838 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -56.59 -52.57 64.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -45.7 84.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -62.9 -22.71 66.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -72.95 -47.73 42.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -30.0 70.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -56.23 15.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.97 -34.39 71.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -69.51 -34.41 74.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 23.5 ttp -68.84 -54.29 16.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -64.29 -35.78 81.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.67 -26.06 54.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.7 t80 -62.81 -55.35 27.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -35.14 62.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 tt0 -68.02 -23.95 65.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -85.82 -43.85 12.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 60.6 t -59.39 -32.47 48.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.55 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 mm-40 -56.54 -65.58 1.57 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.663 0.744 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.74 -52.3 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.637 2.224 . . . . 0.0 112.357 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.24 -65.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.27 -33.95 2.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -76.22 -44.77 36.14 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.88 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -66.86 -43.52 83.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -47.13 73.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -64.99 -42.34 94.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.84 -53.08 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.26 -38.53 83.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.862 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.75 -42.02 99.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -60.21 -53.26 59.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.01 50.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -56.95 -46.03 82.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 5.1 t -59.33 -52.5 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.172 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.36 -52.37 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.845 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.38 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.134 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.19 -44.26 87.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -67.54 -43.99 79.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 23.9 m -55.84 -42.1 75.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.171 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 -33.89 30.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.13 -23.19 62.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -55.49 -62.57 4.24 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.577 0.703 . . . . 0.0 111.043 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.0 Cg_endo -69.72 -43.13 2.87 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.709 2.273 . . . . 0.0 112.324 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -60.9 -28.99 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 12.7 t -59.67 -51.82 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.818 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.29 -48.93 68.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.65 -51.58 68.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.472 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.3 tm? -61.06 -46.57 90.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.875 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -42.96 81.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -34.46 78.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -49.76 57.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -50.58 45.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.94 -35.58 64.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.34 -34.32 55.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.118 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -48.28 81.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.6 pp -68.83 -49.18 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . 0.513 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.2 OUTLIER -58.76 -50.53 73.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.59 87.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.136 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 52.7 tp -67.75 -34.85 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -31.28 66.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.23 -55.73 27.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.96 -26.27 66.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.85 39.08 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.497 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . 0.43 ' HA2' HD23 ' A' ' 189' ' ' LEU . . . -52.08 -33.89 38.21 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.53 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.06 -23.83 38.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -32.53 67.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.43 HD23 ' HA2' ' A' ' 186' ' ' GLY . 1.4 pp -63.14 -36.92 85.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.54 -49.53 32.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.13 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -44.89 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.856 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -60.4 -46.82 88.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.887 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -49.23 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.898 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.89 -31.69 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.46 -49.31 16.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.68 78.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.129 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.9 m -66.32 -47.61 72.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -69.9 -36.24 75.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.44 84.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.872 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 mp -71.23 -30.13 65.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 -51.33 69.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.836 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.66 -50.37 51.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.133 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.97 -54.92 32.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 43.2 m -54.62 -35.66 63.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.827 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.56 -48.35 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.09 -27.8 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.24 -22.01 64.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.501 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 9.9 mmtt -61.21 -63.07 4.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.567 0.699 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 54.6 Cg_endo -69.69 -26.92 27.43 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.717 2.278 . . . . 0.0 112.354 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.71 -32.88 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -36.65 73.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -54.32 -50.62 66.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.48 -30.49 63.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.14 -48.41 78.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 219' ' ' LEU . 0.9 OUTLIER -70.39 -41.97 72.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.7 -25.76 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.955 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.558 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -79.04 -44.49 9.8 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.73 -27.54 68.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.501 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 2.7 mp -50.85 -62.97 2.18 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 0.0 110.892 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.0 Cg_endo -69.69 -44.63 2.01 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.755 2.304 . . . . 0.0 112.328 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 217' ' ' GLY . 90.5 t -55.88 -54.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.133 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.85 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -66.37 -40.12 89.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -48.06 83.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.872 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.91 -38.06 82.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 223' ' ' GLU . 54.7 t -56.78 -49.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.145 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -50.75 72.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.832 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.38 -37.98 82.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.2 -40.59 97.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.28 72.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.91 -44.93 68.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.697 HD23 ' N ' ' A' ' 234' ' ' GLU . 0.0 OUTLIER -61.27 -38.99 88.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . 0.697 ' N ' HD23 ' A' ' 233' ' ' LEU . 0.7 OUTLIER -74.6 -35.4 62.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -68.05 -48.87 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -63.74 -41.01 98.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.97 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 233' ' ' LEU . 37.9 p -70.75 -45.88 63.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.078 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -56.22 -55.07 37.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.83 79.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 30.8 mt -57.77 -37.72 74.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.908 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.891 0.376 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -57.01 10.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.06 -33.73 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.885 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.75 -52.85 54.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -27.8 65.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -58.6 -26.84 64.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -51.02 -47.67 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -29.26 18.86 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.528 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.559 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.1 tm? -49.95 -42.98 49.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -58.15 -49.47 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -44.77 88.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.908 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.21 -50.14 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.26 -42.28 81.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.856 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.88 -50.41 74.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -43.64 90.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.704 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.88 -48.87 77.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 39.1 tp -57.04 -49.49 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.955 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -54.31 -47.83 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -36.11 82.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 89' ' ' ASP . 69.6 t -65.41 -32.7 59.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.099 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -75.09 -52.96 9.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.14 73.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -78.26 -33.83 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.58 -47.53 78.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.139 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.558 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.4 OUTLIER -42.61 -66.23 0.45 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.619 0.723 . . . . 0.0 110.942 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.2 Cg_endo -69.77 -29.6 23.58 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.695 2.264 . . . . 0.0 112.303 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . 0.435 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.5 t80 -58.0 -26.15 62.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.89 -49.43 17.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.932 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.15 -33.55 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.86 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -47.56 63.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -55.83 -52.94 62.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.887 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -47.28 79.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -60.37 -22.33 63.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -74.11 -48.47 29.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.871 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -31.92 73.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.6 -55.45 20.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.96 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -70.7 -34.57 72.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -69.79 -33.0 71.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 20.5 ttp -69.65 -54.4 14.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.64 -35.76 82.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -76.29 -25.98 55.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.738 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.7 t80 -62.92 -55.19 28.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -33.86 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.449 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 2.3 tt0 -69.37 -23.33 63.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -87.47 -44.99 10.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 115' ' ' TYR . 58.9 t -59.9 -32.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.122 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.545 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mm-40 -57.16 -65.35 1.78 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.3 Cg_endo -69.86 -51.4 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.66 2.24 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -65.89 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.942 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.32 -34.17 1.53 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.504 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tp10 -77.14 -47.01 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 110.877 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.32 -47.69 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -51.46 63.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -60.04 -44.13 94.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.21 -52.22 50.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.95 -33.33 73.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.429 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.36 -46.42 83.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 9.7 ttp180 -58.9 -52.71 64.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.51 -54.88 42.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -57.9 -42.6 85.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.6 t -61.08 -51.47 72.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.27 -50.87 28.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.32 -44.65 87.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.093 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -57.93 -41.61 83.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 -67.89 -45.4 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 23.8 m -55.94 -41.23 74.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -81.54 -33.98 31.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.833 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.67 -23.38 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.822 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -55.52 -62.42 4.51 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.546 0.689 . . . . 0.0 111.123 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.822 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.3 Cg_endo -69.77 -41.29 4.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.679 2.253 . . . . 0.0 112.38 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -62.56 -29.34 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 7.7 t -59.62 -51.47 69.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.79 -49.11 69.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.95 -51.57 68.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' B' ' 170' ' ' LEU . 2.4 tm? -60.98 -46.68 89.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -42.62 81.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -34.65 78.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -48.8 63.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.875 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -50.59 40.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.947 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.22 -35.23 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.091 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.33 -34.31 55.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.103 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -48.28 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.904 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.509 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.6 pp -68.99 -48.86 62.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.937 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . 0.509 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.2 OUTLIER -58.72 -50.51 73.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.08 89.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 52.5 tp -67.68 -34.84 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -31.77 66.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -55.12 -55.59 29.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.77 -26.21 66.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.4 -33.67 40.19 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . 0.434 ' HA2' HD23 ' B' ' 189' ' ' LEU . . . -52.01 -34.08 38.03 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.465 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.04 -23.79 38.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.733 0.301 . . . . 0.0 111.097 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -32.52 67.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.434 HD23 ' HA2' ' B' ' 186' ' ' GLY . 1.4 pp -63.08 -37.01 85.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.51 -49.57 31.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.053 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -44.59 90.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.62 -46.96 88.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.43 -49.22 67.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.61 70.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.078 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.49 -49.24 17.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.4 -34.89 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.1 m -65.95 -47.64 73.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.173 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -69.94 -36.23 75.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.885 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.37 84.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.33 -30.07 65.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.83 -51.24 69.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.856 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.75 -50.25 52.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.163 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.17 -54.94 32.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.869 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 43.3 m -54.53 -35.71 63.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.57 -48.31 81.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.07 -27.87 48.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.97 64.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.075 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 9.8 mmtt -61.28 -63.13 4.67 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.597 0.713 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.8 Cg_endo -69.82 -26.7 27.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.03 57.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.34 -36.48 74.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -54.34 -50.31 67.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -30.54 63.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.17 -48.32 79.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . 0.47 ' O ' HD13 ' B' ' 219' ' ' LEU . 0.9 OUTLIER -70.42 -42.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.81 -25.59 68.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.54 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -79.03 -44.62 9.68 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.456 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.64 -27.54 69.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.816 0.341 . . . . 0.0 110.93 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 2.6 mp -50.86 -62.92 2.23 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.593 0.711 . . . . 0.0 110.902 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.2 Cg_endo -69.81 -44.51 2.0 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.672 2.248 . . . . 0.0 112.323 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 217' ' ' GLY . 90.3 t -55.94 -54.19 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.132 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.88 71.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.915 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.746 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.5 mt-10 -66.33 -40.08 89.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -48.05 83.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.847 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -40.19 93.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . 0.404 ' O ' HD23 ' B' ' 230' ' ' LEU . 0.5 OUTLIER -67.96 -38.07 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.746 HG23 ' O ' ' B' ' 223' ' ' GLU . 53.2 t -56.71 -49.09 79.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -50.75 72.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -60.42 -37.93 82.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.404 HD23 ' O ' ' B' ' 226' ' ' LYS . 1.6 mm? -63.24 -40.63 97.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.886 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -31.26 72.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.865 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.92 -44.98 68.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.678 HD23 ' N ' ' B' ' 234' ' ' GLU . 0.0 OUTLIER -61.2 -39.04 88.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . 0.678 ' N ' HD23 ' B' ' 233' ' ' LEU . 0.7 OUTLIER -74.59 -35.51 62.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.827 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.96 -48.86 64.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.913 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -63.75 -41.09 98.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . 0.423 HG23 ' O ' ' B' ' 233' ' ' LEU . 38.0 p -70.69 -45.83 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.123 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -56.22 -55.06 37.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.81 79.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.74 -37.75 74.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.906 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.855 0.359 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.6 -56.43 22.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.58 -34.45 74.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.929 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -56.48 -51.61 67.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -72.14 -32.12 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 82' ' ' LEU . 95.6 m -65.86 -23.69 66.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.135 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.409 ' O ' HD23 ' A' ' 82' ' ' LEU . 5.9 tt0 -50.04 -32.01 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.89 -27.85 14.84 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.592 HD23 ' H ' ' A' ' 83' ' ' ARG . 1.1 pt? -49.15 -34.71 14.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.79 0.329 . . . . 0.0 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.592 ' H ' HD23 ' A' ' 82' ' ' LEU . 3.4 ttm-85 -61.81 -49.88 74.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.12 -43.79 95.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.69 -49.69 74.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.18 -41.55 84.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.918 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -50.1 74.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.881 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.72 -44.29 90.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.24 -47.7 77.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.859 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 37.1 tp -57.39 -50.29 73.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.872 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -47.87 69.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.881 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -64.12 -34.86 79.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 74.4 t -65.54 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -74.71 -52.88 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.833 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.72 -33.11 73.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.119 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -77.37 -33.25 55.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.48 -43.93 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.143 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -43.87 -65.03 0.64 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.586 0.708 . . . . 0.0 110.897 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.75 -31.29 20.84 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.669 2.246 . . . . 0.0 112.375 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.409 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.6 t80 -58.18 -25.54 61.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.19 -50.17 35.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.95 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -64.36 -34.87 79.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.91 -52.39 65.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -64.49 -43.89 92.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -64.38 -22.89 67.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -49.42 34.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . 0.401 ' CD1' ' HD2' ' B' ' 149' ' ' ARG . 0.5 OUTLIER -65.13 -29.06 69.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -56.86 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.878 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -70.99 -34.43 71.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.892 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.01 -34.3 75.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -68.89 -54.03 17.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.82 -35.58 81.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.866 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.62 -26.65 55.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -62.13 -55.24 30.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.945 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -34.01 61.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.86 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 48.2 tt0 -68.17 -23.83 64.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmtt -86.73 -44.33 11.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 55.6 t -59.0 -32.65 48.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.1 mt-10 -56.91 -65.62 1.61 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.666 0.746 . . . . 0.0 110.896 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.1 Cg_endo -69.79 -52.19 0.34 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 0.0 112.302 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.66 -64.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.19 -32.39 2.51 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.514 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -44.85 34.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.868 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -68.06 -41.91 81.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -46.25 74.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.894 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.427 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.5 tpp180 -66.49 -41.59 88.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.73 -52.86 18.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -59.54 -39.87 85.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.77 -41.15 99.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.139 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -52.63 64.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.21 45.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.123 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -56.29 -45.32 80.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.72 -52.17 64.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.088 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.03 -52.35 15.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.881 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.2 93.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.103 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.01 -44.23 87.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.3 -44.59 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 24.3 m -55.58 -42.11 74.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.125 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -81.86 -32.61 31.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.799 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -69.98 -24.51 63.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.929 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.842 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.38 -62.94 3.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.842 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.4 Cg_endo -69.78 -43.36 2.69 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.692 2.261 . . . . 0.0 112.348 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . 0.674 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.9 t80 -58.4 -33.4 69.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.876 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -52.11 64.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -67.06 -31.95 72.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.881 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -66.79 -51.15 59.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.674 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -58.46 -49.76 76.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -36.31 72.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.853 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.82 -52.63 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.53 -47.74 77.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.84 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.1 -51.43 69.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.61 -35.79 63.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.083 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.27 50.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.066 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -48.32 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.868 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.7 pp -67.42 -49.71 62.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' A' ' 178' ' ' LEU . 2.2 pp20? -59.71 -34.09 72.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.27 -45.3 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.081 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.57 -40.97 76.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -75.61 -32.2 60.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -56.82 15.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.844 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.75 -26.33 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.905 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.29 -34.39 40.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.53 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.67 38.77 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.1 39.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.78 0.324 . . . . 0.0 111.08 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -73.56 -32.49 64.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.872 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -37.91 89.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.2 -49.92 31.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.087 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -63.87 -42.1 97.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.1 -45.27 92.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -54.47 -47.9 72.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.829 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.65 72.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -76.04 -50.6 14.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.34 93.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.119 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . 0.547 HG21 HD13 ' B' ' 240' ' ' LEU . 83.6 m -61.43 -47.48 85.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -36.51 83.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.853 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.57 -44.66 89.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.842 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -71.85 -30.09 65.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.6 m -57.44 -51.37 69.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -51.06 50.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.197 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.33 -54.84 34.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 50.7 m -54.53 -35.23 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.09 -47.8 83.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -77.71 -30.28 51.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . 0.479 ' O ' HD23 ' A' ' 211' ' ' LEU . . . -68.22 -22.13 64.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.126 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.514 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -59.14 -63.37 4.26 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 110.904 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.514 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.75 -24.73 29.4 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.722 2.282 . . . . 0.0 112.348 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.2 -32.5 59.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.092 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.506 HD13 HD22 ' A' ' 214' ' ' LEU . 1.9 mm? -73.12 -35.88 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -53.85 -51.6 63.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.15 -30.85 58.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.506 HD22 HD13 ' A' ' 211' ' ' LEU . 2.9 tt -61.89 -51.26 68.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.949 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.48 -37.13 84.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -56.74 -48.87 76.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.877 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.53 -29.53 74.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.478 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.24 -32.96 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.348 . . . . 0.0 110.921 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -49.81 -61.14 3.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.644 0.735 . . . . 0.0 110.912 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.76 -39.61 6.31 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.663 2.242 . . . . 0.0 112.363 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.8 t -58.0 -54.73 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.21 74.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.679 ' O ' HG23 ' A' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.34 80.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 14.1 m -59.88 -48.19 82.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -43.1 94.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 223' ' ' GLU . 51.6 t -55.76 -43.56 74.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.2 -50.45 73.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -61.09 -38.98 88.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.793 HD22 HD11 ' A' ' 233' ' ' LEU . 3.0 tm? -62.19 -33.39 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -31.43 67.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.795 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.44 -53.05 39.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.119 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 230' ' ' LEU . 0.8 OUTLIER -66.18 -43.3 87.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.941 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.3 -34.65 78.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.55 -49.34 75.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.23 -45.83 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.907 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.36 -45.95 88.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.15 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.11 -53.89 50.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -45.88 77.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.502 HD13 HG21 ' B' ' 197' ' ' THR . 13.1 tp -56.91 -37.42 71.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.842 179.883 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.3 t30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.876 0.37 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.45 -56.4 22.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.8 -34.31 74.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -56.41 -51.54 67.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -72.23 -32.33 66.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' B' ' 82' ' ' LEU . 95.5 m -65.58 -23.54 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.153 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.22 -32.14 15.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -27.98 14.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.435 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.594 HD23 ' H ' ' B' ' 83' ' ' ARG . 1.1 pt? -49.09 -34.61 14.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.314 . . . . 0.0 110.892 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . 0.594 ' H ' HD23 ' B' ' 82' ' ' LEU . 3.5 ttm-85 -61.85 -49.96 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.854 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.16 -43.75 95.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.67 -49.62 74.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.41 -41.34 84.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.75 -44.37 90.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.714 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.1 -47.91 77.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.54 -49.88 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.924 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.46 -47.58 69.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -64.52 -34.93 79.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 89' ' ' ASP . 71.0 t -65.52 -32.9 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.129 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -75.36 -53.3 8.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.78 74.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.117 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -77.45 -33.43 54.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -55.31 -47.75 77.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.14 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.565 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -42.28 -66.49 0.41 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.609 0.719 . . . . 0.0 110.91 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.565 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.74 -30.45 22.37 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.8 t80 -57.5 -25.04 59.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.907 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.42 -49.4 19.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -59.68 -34.7 73.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.874 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -47.49 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -55.99 -52.57 63.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.46 -44.62 90.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -62.71 -22.5 66.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -50.28 22.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.906 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.42 -30.58 71.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -56.44 13.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.42 -34.88 73.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -69.14 -32.52 71.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.913 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . 0.427 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 2.7 tmm? -69.8 -54.01 15.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.893 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -65.6 -35.43 80.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.18 -26.63 56.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.74 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.4 t80 -62.51 -55.07 30.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.957 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -33.36 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 48.8 tt0 -69.12 -22.78 63.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -88.39 -46.39 9.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.74 HG23 ' O ' ' B' ' 115' ' ' TYR . 56.4 t -58.72 -32.59 46.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.135 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 1.0 OUTLIER -57.5 -65.53 1.74 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.616 0.722 . . . . 0.0 110.871 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.69 -51.66 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.685 2.257 . . . . 0.0 112.338 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -65.37 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.78 -32.0 2.03 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.27 -46.79 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.43 -46.34 73.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -51.96 61.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.401 ' HD2' ' CD1' ' A' ' 108' ' ' TRP . 12.9 tpp180 -60.32 -43.14 96.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.883 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.49 -52.01 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -59.97 -34.07 72.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.406 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.51 -45.27 87.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.115 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.852 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.25 -54.94 39.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.075 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -56.76 -43.87 81.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.862 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.8 t -60.21 -51.34 74.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.48 -51.49 20.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.8 90.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.115 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.08 -42.24 85.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.912 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.55 -45.63 75.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 24.2 m -55.61 -41.52 73.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.145 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -81.51 -32.89 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.25 -24.6 63.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.833 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.23 -62.75 3.46 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.605 0.717 . . . . 0.0 111.089 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.833 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.7 Cg_endo -69.75 -42.37 3.47 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 0.0 112.346 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . 0.66 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.3 t80 -59.57 -33.68 71.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.43 -52.0 65.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -66.76 -32.34 73.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.8 -51.0 60.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.66 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.49 -49.57 76.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -36.13 72.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -52.43 62.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.891 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.16 -47.72 78.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.861 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.41 -51.22 70.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.903 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . 0.527 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -54.82 -35.45 63.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.12 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.34 50.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -47.94 60.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.8 pp -67.85 -49.55 61.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' B' ' 178' ' ' LEU . 2.1 pp20? -59.57 -34.21 72.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.31 -45.39 47.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.068 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.84 -40.93 76.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -75.64 -32.85 60.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.899 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -56.53 18.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.67 -26.31 60.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.855 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.45 -34.22 41.67 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.457 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.13 -33.71 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.529 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.11 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -73.54 -32.74 64.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -38.15 90.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.15 -49.71 33.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.124 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.97 -41.83 97.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.29 -45.46 91.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.33 -47.75 72.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.881 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.35 -31.55 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.084 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -76.03 -50.52 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.63 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.126 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . 0.502 HG21 HD13 ' A' ' 240' ' ' LEU . 80.9 m -61.27 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.166 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -36.51 83.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.6 -44.55 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.01 -30.13 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 9.2 m -57.45 -51.24 70.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.835 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -51.02 50.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.137 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.44 -54.84 35.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.875 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 50.3 m -54.69 -35.09 63.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.1 -47.77 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -77.81 -30.4 51.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.883 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . 0.483 ' O ' HD23 ' B' ' 211' ' ' LEU . . . -68.19 -22.1 64.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.127 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.519 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -59.15 -63.48 4.12 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.556 0.693 . . . . 0.0 110.911 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.9 Cg_endo -69.81 -24.71 29.12 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.332 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.29 -32.29 58.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . 0.498 HD13 HD22 ' B' ' 214' ' ' LEU . 1.8 mm? -73.19 -35.78 66.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -53.78 -51.45 63.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.914 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.16 -30.78 58.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.498 HD22 HD13 ' B' ' 211' ' ' LEU . 2.9 tt -61.95 -51.36 68.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.35 -37.12 84.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -56.76 -48.8 77.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.554 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.55 -29.41 73.98 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.5 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.27 -32.98 74.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.897 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.0 OUTLIER -49.79 -61.13 3.91 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.62 0.724 . . . . 0.0 110.931 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.73 -39.71 6.24 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.707 2.271 . . . . 0.0 112.349 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.06 -54.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.113 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.17 74.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.681 ' O ' HG23 ' B' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.37 80.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 14.0 m -59.86 -48.18 82.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.3 -41.94 96.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -43.15 94.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 223' ' ' GLU . 51.4 t -55.68 -43.49 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.152 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.34 -50.33 74.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -61.13 -39.01 88.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.854 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.755 HD22 HD11 ' B' ' 233' ' ' LEU . 3.0 tm? -62.18 -33.4 74.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.57 -31.34 66.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.06 39.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.143 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.755 HD11 HD22 ' B' ' 230' ' ' LEU . 0.8 OUTLIER -66.13 -43.23 87.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.917 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.34 -34.62 78.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.65 -49.25 75.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.18 -45.96 86.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.953 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.27 -45.97 88.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.119 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.17 -53.84 50.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -45.91 77.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.547 HD13 HG21 ' A' ' 197' ' ' THR . 13.1 tp -56.77 -37.52 71.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.922 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.943 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -45.51 64.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.55 65.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.58 -32.04 65.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.14 -48.53 78.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.37 -45.48 31.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.124 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.57 -30.84 67.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.931 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.42 56.09 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.452 HD11 HD21 ' B' ' 178' ' ' LEU . 8.7 mt -58.89 -35.8 73.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -49.62 77.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -68.6 -48.21 64.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.12 -29.19 69.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.855 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.56 -51.81 13.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.0 p -65.66 -35.88 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -40.63 64.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -61.96 -48.09 81.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.67 -50.94 55.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -58.01 -42.47 85.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.89 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.45 -47.94 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.898 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 97' ' ' VAL . 4.4 t -56.72 -33.16 39.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.114 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -52.32 10.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.87 -35.61 77.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -79.27 -34.92 42.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.429 ' HA ' ' HB2' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -53.51 -44.77 57.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.112 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.56 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -47.67 -65.96 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.58 0.705 . . . . 0.0 110.92 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.56 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.6 Cg_endo -69.71 -24.87 29.42 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.668 2.245 . . . . 0.0 112.347 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.429 ' HB2' ' HA ' ' A' ' 97' ' ' VAL . 2.7 m-30 -61.35 -35.08 76.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -51.66 16.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.943 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.05 -34.27 77.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.62 -47.32 76.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.41 -52.05 67.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -64.73 -47.52 77.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -63.99 -22.68 67.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.908 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -71.11 -48.52 51.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -23.31 57.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -64.99 -60.02 3.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.66 -34.32 73.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.42 -30.51 69.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -71.8 -53.28 13.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.87 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.29 -35.02 79.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 114' ' ' LEU . 3.1 tm? -76.35 -26.19 55.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.71 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.2 t80 -65.65 -54.76 23.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.951 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.87 -33.9 66.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.417 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 22.1 tt0 -70.19 -23.09 62.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -90.3 -45.22 9.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 115' ' ' TYR . 94.5 t -59.98 -32.45 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.139 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.539 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -57.88 -64.68 2.45 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.637 0.732 . . . . 0.0 110.901 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.4 Cg_endo -69.8 -50.94 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.679 2.253 . . . . 0.0 112.32 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -63.54 1.04 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.5 -30.47 4.49 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.496 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.52 -43.32 56.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.328 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.19 -33.96 63.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 2.6 ttt -66.99 -48.94 66.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -38.26 86.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.872 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -71.57 -52.58 17.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.8 mmt-85 -63.0 -38.2 90.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.28 -37.69 88.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -64.04 -49.89 70.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.6 -38.67 70.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.043 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -66.9 -50.74 61.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 152' ' ' ALA . 4.8 p -64.32 -40.62 89.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.418 ' N ' ' CG1' ' A' ' 156' ' ' VAL . 22.4 t0 -52.61 -50.56 62.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.833 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.48 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.099 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.96 -38.73 73.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -68.51 -45.57 71.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.839 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 34.7 m -55.4 -40.98 72.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.77 -34.04 30.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.02 -21.47 62.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -56.44 -62.66 4.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.61 0.719 . . . . 0.0 111.098 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.9 Cg_endo -69.74 -42.23 3.61 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.335 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . 0.412 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.5 t80 -55.76 -33.68 64.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -51.58 69.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.834 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.73 -32.69 73.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.864 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -50.05 72.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.412 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -59.21 -49.59 77.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.69 -37.74 76.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.62 -51.79 68.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.44 -38.69 81.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -41.92 75.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -45.45 75.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.25 -34.57 70.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.078 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.86 -37.5 87.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.603 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -68.09 -51.6 44.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.89 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . 0.603 ' N ' HD23 ' A' ' 178' ' ' LEU . 10.2 pt-20 -65.93 -40.64 91.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.77 -46.48 77.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -35.88 79.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.898 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -31.84 69.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.888 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -56.15 21.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.865 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.8 -25.76 63.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.53 -31.72 44.67 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.511 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -64.02 -49.88 64.35 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.46 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.68 -21.83 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.322 . . . . 0.0 111.127 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -71.76 -29.11 64.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -49.91 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.914 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.45 -48.95 68.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.115 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -63.37 -51.45 65.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.903 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -54.11 -48.93 70.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.91 69.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.68 -42.4 41.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.922 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.94 -47.7 73.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.137 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 40.0 p -60.07 -46.82 88.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.187 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.88 -35.86 75.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.12 -54.27 46.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -28.7 64.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.53 -51.41 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.817 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -50.85 30.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.71 -57.34 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -54.46 -35.96 63.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.99 -47.84 81.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -27.75 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.31 66.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.524 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.0 OUTLIER -64.61 -63.99 3.17 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.581 0.705 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.524 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.4 Cg_endo -69.77 -26.85 27.13 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.724 2.283 . . . . 0.0 112.298 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.73 -31.75 59.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 5.7 tt -71.2 -40.83 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.65 -51.16 66.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -75.99 -29.81 58.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.851 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -45.78 91.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . 0.652 ' O ' HD13 ' A' ' 219' ' ' LEU . 8.4 mtp180 -72.92 -40.03 65.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -68.06 -25.12 65.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -80.7 -49.84 5.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -27.99 69.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.846 0.355 . . . . 0.0 110.925 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.652 HD13 ' O ' ' A' ' 215' ' ' ARG . 1.4 mp -50.51 -63.43 1.85 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.596 0.712 . . . . 0.0 110.948 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.2 Cg_endo -69.74 -46.44 1.23 Allowed 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.709 2.272 . . . . 0.0 112.363 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 217' ' ' GLY . 94.0 t -54.59 -55.09 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.187 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.06 -31.71 70.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.937 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 227' ' ' VAL . 22.1 tt0 -69.11 -36.28 77.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.58 83.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.22 -44.22 97.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -40.25 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 223' ' ' GLU . 38.9 t -55.38 -48.39 76.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.102 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 2.3 t -59.02 -50.11 75.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.831 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.09 -35.22 79.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.859 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 230' ' ' LEU . 0.3 OUTLIER -64.09 -34.24 77.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.908 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 67.4 m -73.56 -31.4 63.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.55 57.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.113 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.514 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.7 pp -64.9 -37.93 89.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.5 -34.97 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.36 -49.9 57.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -58.93 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.905 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 35.1 m -67.88 -39.81 83.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.145 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.63 -54.17 49.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -48.99 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.945 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.06 -33.47 69.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 179.943 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.88 0.372 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.02 -45.42 63.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.0 -33.58 65.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.48 -32.13 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.1 -48.56 78.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -45.49 31.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.118 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.55 -30.98 67.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.878 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.38 -33.49 56.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.441 HD11 HD21 ' A' ' 178' ' ' LEU . 8.6 mt -58.85 -35.78 73.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.794 0.331 . . . . 0.0 110.9 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -49.73 76.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -68.49 -48.0 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.34 -29.1 69.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.53 -51.6 14.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.912 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 19.1 p -65.93 -35.9 81.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.862 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -40.61 64.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.41 ' O ' HG23 ' B' ' 93' ' ' VAL . 12.2 m-20 -62.15 -48.58 79.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.3 -50.75 59.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -57.78 -42.79 84.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.88 -45.05 60.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.495 ' O ' HG23 ' B' ' 97' ' ' VAL . 4.0 t -59.59 -33.93 53.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.134 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -53.91 7.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.87 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.124 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.8 tptt -79.14 -35.89 41.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.898 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 93' ' ' VAL . 0.9 OUTLIER -50.69 -47.64 28.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.113 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.595 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -45.73 -68.07 0.33 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.576 0.703 . . . . 0.0 110.941 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.4 Cg_endo -69.74 -18.11 37.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.696 2.264 . . . . 0.0 112.35 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -66.18 -34.36 77.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.96 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -50.81 11.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.49 -35.52 74.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.93 -46.84 73.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -52.24 66.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.44 -47.93 74.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -62.52 -22.51 66.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -72.31 -48.42 42.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -24.98 59.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.888 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.17 -60.8 2.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.47 -34.59 77.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -69.19 -30.43 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.885 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -70.37 -53.67 15.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -66.68 -35.03 79.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.586 HD13 ' O ' ' B' ' 114' ' ' LEU . 3.1 tm? -76.06 -26.21 56.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.888 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.704 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.3 t80 -65.56 -54.94 20.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -73.12 -33.56 65.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.427 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 22.6 tt0 -70.45 -22.56 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.927 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -91.13 -45.61 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 115' ' ' TYR . 91.8 t -60.26 -32.77 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.155 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -58.04 -64.54 2.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.644 0.735 . . . . 0.0 110.892 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.1 Cg_endo -69.76 -50.29 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.685 2.257 . . . . 0.0 112.319 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -64.09 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.876 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.43 3.74 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.493 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -75.37 -45.39 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.822 0.344 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.72 -35.93 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 1.8 ttt -66.66 -54.04 27.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.877 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -39.3 93.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -68.83 -52.68 27.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 7.4 mmt-85 -63.63 -32.26 73.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.482 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.31 -42.89 92.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.082 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -62.18 -46.54 88.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.22 69.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.08 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -66.76 -50.67 61.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.482 HG12 ' O ' ' B' ' 152' ' ' ALA . 9.8 p -63.49 -40.02 87.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.168 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . 0.415 ' N ' HG13 ' B' ' 156' ' ' VAL . 21.0 t0 -52.84 -50.32 63.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.73 -48.96 67.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.145 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.39 -38.07 73.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 20.7 tpp85 -68.61 -45.15 72.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 34.8 m -55.8 -40.83 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.94 -34.07 29.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.836 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.33 -21.63 62.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -56.15 -62.39 4.85 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 0.0 111.092 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.1 Cg_endo -69.71 -41.56 4.23 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.724 2.282 . . . . 0.0 112.367 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . 0.416 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.4 t80 -56.51 -34.22 66.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.955 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.15 -51.45 69.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.69 -32.91 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -50.06 71.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.416 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.9 -37.96 77.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -51.66 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.937 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -39.34 81.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.867 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -41.59 77.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.15 75.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.87 71.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.77 -36.97 86.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.817 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . 0.589 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.3 tt -68.59 -51.37 43.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.897 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . 0.589 ' N ' HD23 ' B' ' 178' ' ' LEU . 10.0 pt-20 -65.45 -42.19 92.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.945 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.19 77.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.084 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -35.35 77.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -31.51 70.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.952 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -55.85 24.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.81 -25.82 63.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.54 -31.97 45.17 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.464 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -63.83 -49.9 64.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.495 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.86 -21.65 43.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.071 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -71.89 -29.11 64.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -49.9 75.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.39 -49.02 68.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.114 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.22 -34.2 76.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.867 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.2 -51.56 65.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.917 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -54.02 -48.8 70.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.835 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.82 69.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.123 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.73 -42.34 41.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.71 73.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 39.9 p -60.12 -46.82 88.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.084 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.87 -35.83 75.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.21 -54.32 45.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.821 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.07 -28.71 64.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.54 -51.27 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.81 30.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.117 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.84 -57.28 11.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.5 m -54.43 -35.98 63.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.97 -47.81 81.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.81 -27.78 44.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.46 -23.35 66.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.151 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.523 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.0 OUTLIER -64.47 -64.01 3.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.574 0.702 . . . . 0.0 110.923 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -26.89 27.36 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 0.0 112.331 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.68 -31.69 59.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.099 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 5.6 tt -71.13 -40.97 71.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.57 -51.12 66.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.903 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.94 -29.87 58.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.02 -45.69 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.91 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . 0.64 ' O ' HD13 ' B' ' 219' ' ' LEU . 8.6 mtp180 -73.01 -39.83 65.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.23 -25.07 65.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.547 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -80.69 -49.94 5.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.472 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -28.01 69.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.866 0.365 . . . . 0.0 110.896 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.64 HD13 ' O ' ' B' ' 215' ' ' ARG . 1.4 mp -50.45 -63.44 1.84 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.615 0.721 . . . . 0.0 110.921 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.82 -46.51 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.662 2.242 . . . . 0.0 112.338 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.547 HG23 ' O ' ' B' ' 217' ' ' GLY . 91.9 t -54.56 -55.08 17.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.124 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.08 -31.79 70.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.896 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.702 ' O ' HG23 ' B' ' 227' ' ' VAL . 22.0 tt0 -69.1 -36.17 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -47.65 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.24 -44.18 97.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.864 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -40.33 95.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.702 HG23 ' O ' ' B' ' 223' ' ' GLU . 38.6 t -55.39 -48.34 77.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.085 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 2.2 t -59.07 -50.06 75.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -35.33 79.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.541 HD13 ' O ' ' B' ' 230' ' ' LEU . 0.3 OUTLIER -64.1 -34.14 77.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 67.3 m -73.62 -31.41 63.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.57 56.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.077 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.7 pp -64.92 -37.95 89.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.41 -34.93 68.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.92 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.38 -50.01 56.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -58.87 -47.1 86.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.3 m -67.9 -39.86 83.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.61 -54.18 48.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -48.98 77.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 58.9 tp -58.08 -33.52 69.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.889 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.873 179.948 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.838 0.352 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.82 -54.91 39.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.58 -36.09 77.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -50.73 70.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.06 -31.44 61.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.662 HG23 HD23 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -59.01 -22.07 60.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.149 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.58 -34.18 17.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.84 -27.04 19.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.476 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.662 HD23 HG23 ' A' ' 79' ' ' THR . 2.0 pp -48.36 -35.65 12.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.789 0.328 . . . . 0.0 110.93 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -60.27 -50.21 74.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -45.08 96.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -49.06 73.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.13 -40.78 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -50.66 73.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.78 -46.27 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 22.2 t0 -55.6 -46.15 77.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -57.48 -50.24 73.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -48.58 69.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.21 -36.68 84.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 70.5 t -64.99 -32.03 56.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -73.92 -52.64 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.85 -33.66 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.103 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -77.89 -32.85 52.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.35 -43.59 86.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.178 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 mm-40 -43.59 -65.21 0.61 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.701 . . . . 0.0 110.866 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.74 -32.15 19.24 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.712 2.274 . . . . 0.0 112.306 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.404 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.2 t80 -58.58 -25.02 62.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.929 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.58 -51.07 25.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -33.0 74.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.872 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -47.54 68.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.825 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.91 -52.46 64.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -64.58 -47.27 79.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.914 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -60.31 -22.96 63.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -74.71 -46.87 34.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.942 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -29.79 70.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -68.64 -54.61 15.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.896 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -35.12 73.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.849 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -70.41 -30.48 67.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -71.43 -53.26 14.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.916 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.36 -35.03 79.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.8 tp -76.15 -26.12 55.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.706 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.1 t80 -66.48 -54.18 26.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.951 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -72.96 -34.05 66.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 43.1 tt0 -70.34 -23.79 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.93 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -89.04 -45.05 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.87 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 115' ' ' TYR . 99.5 t -61.33 -32.12 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.538 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.3 OUTLIER -56.22 -64.69 2.1 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.626 0.727 . . . . 0.0 110.845 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.5 Cg_endo -69.76 -52.02 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.693 2.262 . . . . 0.0 112.326 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -63.02 1.2 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.57 -32.38 2.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.458 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.31 -44.09 47.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.354 . . . . 0.0 110.927 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.56 -36.86 73.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -48.33 66.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.916 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -68.82 -37.75 79.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.2 -52.86 16.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -62.42 -41.37 98.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.64 -39.87 92.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.092 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -62.23 -53.12 59.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.12 61.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -60.58 -45.16 94.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.83 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.11 -53.72 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.37 -52.64 20.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.4 96.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.54 -41.89 86.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.941 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -65.54 -48.26 73.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 21.3 m -55.56 -42.46 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.129 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.88 -32.44 51.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.15 -19.63 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.8 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.68 -62.38 6.0 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.607 0.718 . . . . 0.0 111.121 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.8 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.1 Cg_endo -69.86 -47.12 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 0.0 112.327 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . 0.5 ' O ' HD13 ' A' ' 170' ' ' LEU . 19.7 m-30 -55.92 -27.44 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -51.35 64.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.846 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.32 -34.51 78.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -51.96 21.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.932 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 166' ' ' TYR . 8.8 mp -61.14 -49.45 77.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -61.22 -33.71 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -52.33 64.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.61 -43.1 69.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.97 -50.63 72.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.76 -32.81 74.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.25 -42.02 60.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.068 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -73.77 -32.09 63.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.69 -49.54 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.948 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.23 -35.59 71.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.02 -47.89 60.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.16 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.55 -43.32 93.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -32.43 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -51.03 68.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.92 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -69.08 -26.32 64.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.56 42.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.453 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.43 -31.9 36.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.462 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.47 -25.62 41.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -38.23 64.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -37.26 80.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.957 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.24 -48.78 40.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -47.99 81.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.29 -44.04 95.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.896 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.08 -47.44 71.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.861 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.49 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -76.07 -51.31 12.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.845 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.63 -45.66 78.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . 0.507 HG21 HD13 ' B' ' 240' ' ' LEU . 95.3 m -59.59 -46.86 87.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.66 -38.65 91.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.59 -40.62 83.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.865 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -32.08 65.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.891 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . 0.727 ' OG ' HG23 ' B' ' 237' ' ' THR . 0.5 OUTLIER -57.79 -50.99 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.854 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.29 -51.27 59.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.186 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.77 -50.23 68.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.82 -35.23 68.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.72 -47.81 84.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -31.75 56.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.34 63.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.085 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.5 OUTLIER -60.41 -63.12 4.66 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.601 0.715 . . . . 0.0 110.916 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.73 -27.65 26.37 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.68 2.254 . . . . 0.0 112.364 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.41 -31.82 58.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.29 -36.39 68.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.84 -50.91 65.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -73.68 -34.0 64.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.6 tt -61.46 -49.29 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.93 -36.1 83.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -57.03 -48.79 77.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.553 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.6 -29.52 74.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.438 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.19 -32.51 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.921 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.4 OUTLIER -49.42 -60.79 4.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.602 0.715 . . . . 0.0 110.947 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.82 -39.01 6.89 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.679 2.253 . . . . 0.0 112.333 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 217' ' ' GLY . 49.0 t -58.17 -55.33 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 -34.42 73.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.1 OUTLIER -66.58 -34.78 78.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -48.32 82.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.17 -42.5 79.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -63.08 -46.58 86.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 223' ' ' GLU . 40.1 t -56.89 -39.91 68.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.129 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 28.7 m -58.67 -50.26 74.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -61.25 -36.76 80.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.912 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.482 ' HA ' HD21 ' A' ' 233' ' ' LEU . 1.8 tp -63.71 -34.39 77.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -30.82 66.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.31 -51.37 53.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.111 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.0 OUTLIER -67.56 -44.79 77.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.867 -179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -35.81 79.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.13 -48.9 66.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -54.16 -40.72 67.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' OG ' ' B' ' 201' ' ' SER . 97.1 m -73.09 -40.23 65.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.54 -54.83 39.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -37.41 78.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . 0.474 HD13 HG21 ' B' ' 197' ' ' THR . 2.3 tp -57.68 -38.16 74.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 179.921 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.888 0.375 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.65 -54.92 39.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.75 -35.97 77.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.46 -50.69 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.887 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.12 -31.4 61.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . 0.653 HG23 HD23 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -58.92 -22.07 59.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.145 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.7 -34.25 18.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.89 -27.09 20.0 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.653 HD23 HG23 ' B' ' 79' ' ' THR . 2.0 pp -48.46 -35.58 13.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 0.0 110.903 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 64.6 ttt-85 -60.3 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -45.04 96.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.89 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.08 73.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.27 -40.62 86.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.94 -50.62 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.95 -46.43 88.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.699 ' O ' HG23 ' B' ' 93' ' ' VAL . 22.1 t0 -55.38 -46.4 76.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 60.6 mt -57.46 -50.1 74.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -48.62 69.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.41 -36.58 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.901 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 89' ' ' ASP . 73.6 t -65.12 -32.07 56.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.16 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -74.38 -53.07 10.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.921 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.0 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -78.22 -33.05 50.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.13 -46.79 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.568 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.6 mm-40 -42.75 -66.52 0.42 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.663 0.744 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.568 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.78 -31.54 20.24 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.698 2.265 . . . . 0.0 112.305 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . 0.443 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 12.7 t80 -58.17 -24.19 58.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.52 -50.02 16.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.914 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -33.04 70.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.86 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -46.76 65.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -53.42 56.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -63.51 -47.72 80.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.937 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -61.06 -22.21 64.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -72.74 -48.08 41.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -63.4 -31.41 72.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.8 -55.82 20.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.1 -34.44 71.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.39 -32.75 70.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -53.45 18.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.4 -35.84 82.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.908 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -76.22 -25.96 55.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.877 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.696 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.4 t80 -65.68 -54.62 25.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -73.47 -33.59 64.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.867 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.421 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 44.0 tt0 -70.36 -23.05 62.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -90.83 -45.17 8.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.905 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.696 HG23 ' O ' ' B' ' 115' ' ' TYR . 87.6 t -60.8 -32.46 52.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.532 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.2 OUTLIER -58.15 -64.47 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.648 0.737 . . . . 0.0 110.864 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.532 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 54.2 Cg_endo -69.75 -50.41 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.712 2.275 . . . . 0.0 112.362 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -64.74 0.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.65 -31.96 2.75 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.496 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.1 -46.06 30.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.877 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.15 -41.0 77.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -52.21 58.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -64.43 -37.36 87.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.847 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.55 -51.81 46.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -64.59 -35.19 80.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -63.88 -45.63 88.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.065 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -60.04 -52.53 64.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -55.5 -54.54 42.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -61.52 -40.47 94.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 152' ' ' ALA . 2.6 t -60.03 -52.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -51.26 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.26 -45.61 93.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.073 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -40.21 81.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.937 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -66.15 -47.83 72.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 21.4 m -56.14 -42.64 77.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.132 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.37 -32.84 55.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.48 -19.22 62.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.02 -62.08 6.61 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.535 0.683 . . . . 0.0 111.043 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.5 Cg_endo -69.81 -46.52 1.18 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.669 2.246 . . . . 0.0 112.312 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . 0.506 ' O ' HD13 ' B' ' 170' ' ' LEU . 19.6 m-30 -56.68 -27.79 59.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.1 66.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.815 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -52.03 20.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.506 HD13 ' O ' ' B' ' 166' ' ' TYR . 8.9 mp -61.04 -49.17 78.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -61.46 -33.72 74.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.874 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.66 -52.16 65.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.892 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.16 -43.57 70.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.4 tp -60.82 -50.46 73.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.9 -32.87 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.97 60.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.101 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -73.84 -31.95 63.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.867 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.48 -48.74 66.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.11 -38.88 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -67.03 -46.96 72.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -60.85 -42.18 97.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.926 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -33.07 67.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -50.54 69.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -69.09 -26.39 64.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.43 -34.55 42.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.9 36.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.35 -25.76 42.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.809 0.338 . . . . 0.0 111.11 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -38.31 64.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -37.27 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.16 -48.79 40.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -47.74 82.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.49 -43.96 96.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.947 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.13 -47.51 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.841 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.15 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -76.01 -51.25 12.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.73 -45.7 77.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.071 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . 0.474 HG21 HD13 ' A' ' 240' ' ' LEU . 94.9 m -59.58 -46.79 87.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.132 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -63.75 -38.6 91.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.848 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -58.62 -40.66 83.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.94 -32.0 64.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . 0.706 ' OG ' HG23 ' A' ' 237' ' ' THR . 0.5 OUTLIER -57.78 -50.97 71.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.876 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.34 -51.24 59.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.184 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.82 -50.2 69.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.89 -35.26 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.65 -47.84 84.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -31.86 56.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.24 63.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.12 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.5 OUTLIER -60.55 -63.18 4.6 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 0.0 110.892 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -27.74 26.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.676 2.251 . . . . 0.0 112.365 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.37 -31.77 58.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.088 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.21 -36.28 69.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.81 -50.86 65.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.53 -34.2 65.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.824 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.38 -49.36 77.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.78 -36.16 83.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.84 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -57.03 -48.82 77.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.916 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.54 -29.46 74.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.508 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.25 -32.56 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.331 . . . . 0.0 110.883 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.4 OUTLIER -49.38 -60.86 4.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.597 0.713 . . . . 0.0 110.927 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 54.1 Cg_endo -69.69 -39.08 7.09 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.717 2.278 . . . . 0.0 112.383 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 49.0 t -58.21 -55.31 23.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.136 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -34.38 73.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.1 OUTLIER -66.63 -34.74 78.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -48.34 82.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.866 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.13 -42.62 79.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.08 -46.53 86.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' B' ' 223' ' ' GLU . 39.8 t -56.88 -39.92 68.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.142 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 28.5 m -58.73 -50.21 74.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.874 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.26 -36.77 80.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.475 ' HA ' HD21 ' B' ' 233' ' ' LEU . 1.8 tp -63.72 -34.31 77.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.55 -30.78 66.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.28 53.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.073 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.475 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.0 OUTLIER -67.61 -44.75 77.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -35.73 79.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -67.2 -48.91 66.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.838 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -54.22 -40.7 67.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . 0.727 HG23 ' OG ' ' A' ' 201' ' ' SER . 96.9 m -73.07 -40.24 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.153 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.61 -54.75 40.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.903 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.06 -37.35 78.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.507 HD13 HG21 ' A' ' 197' ' ' THR . 2.2 tp -57.58 -38.24 74.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.869 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.919 179.954 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.873 0.368 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -56.5 21.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.918 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.06 -34.9 72.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -56.59 -51.33 69.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -32.07 65.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.21 -24.75 67.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.158 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -50.91 -33.13 22.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.03 -26.84 9.24 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.508 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -47.4 -40.7 18.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.626 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.1 mtt-85 -59.44 -49.83 76.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.12 -47.39 85.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.75 -49.69 67.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -40.37 82.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -59.88 -50.78 72.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.7 -46.21 87.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.666 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.1 t0 -55.47 -47.66 75.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.83 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -48.1 80.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.55 -47.57 76.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -36.58 83.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.666 HG23 ' O ' ' A' ' 89' ' ' ASP . 72.9 t -66.58 -31.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.162 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -52.75 10.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.83 -33.71 75.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -77.35 -33.51 55.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -59.5 -42.15 87.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.103 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.536 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.1 OUTLIER -44.92 -64.73 0.78 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.611 0.72 . . . . 0.0 110.918 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.78 -31.52 20.25 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.679 2.253 . . . . 0.0 112.34 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.423 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 16.4 t80 -60.78 -24.88 66.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.937 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.23 -50.8 24.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.945 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -65.66 -34.24 77.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.858 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -47.32 77.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -52.26 66.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.84 -46.9 82.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.25 -22.58 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.902 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -71.46 -45.54 62.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.887 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -25.67 61.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.936 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -65.47 -59.53 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -67.83 -34.31 76.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.2 -31.46 68.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.916 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -68.41 -54.11 19.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.87 -34.74 78.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.929 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.74 -26.19 54.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.94 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.674 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -64.35 -54.57 30.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -33.28 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -71.34 -24.92 62.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -87.18 -47.07 9.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.674 HG23 ' O ' ' A' ' 115' ' ' TYR . 72.7 t -60.89 -31.27 49.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.158 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.537 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 3.7 mt-10 -54.74 -64.7 1.77 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.583 0.706 . . . . 0.0 110.838 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.7 Cg_endo -69.77 -54.96 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.41 -62.48 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.01 -31.52 4.32 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.83 -42.77 57.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.796 0.331 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.19 -35.26 66.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 16.6 mtp -67.1 -48.92 66.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -37.54 79.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.841 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -71.0 -52.05 21.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -63.28 -35.65 81.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.935 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.608 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.77 -41.25 96.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.063 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -62.76 -47.97 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.08 -32.57 67.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -69.67 -50.43 44.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' VAL . . . . . 0.608 HG12 ' O ' ' A' ' 152' ' ' ALA . 14.6 p -66.26 -41.2 88.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.443 ' N ' HG13 ' A' ' 156' ' ' VAL . 25.6 t70 -53.39 -52.86 57.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.37 -48.36 75.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.2 -38.55 73.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -44.08 78.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.61 -42.99 79.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -80.95 -29.77 35.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 34.8 tp -70.69 -18.2 62.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' ALA . . . . . 0.804 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.95 -63.11 4.63 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.572 0.701 . . . . 0.0 111.106 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.804 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.3 Cg_endo -69.71 -44.88 1.85 Allowed 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.722 2.281 . . . . 0.0 112.356 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' TYR . . . . . 0.57 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 15.3 t80 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.907 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.6 -49.18 72.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.17 -46.66 87.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.3 -52.33 54.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.57 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 17.8 tp -58.59 -47.69 83.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 8.7 mmp_? -56.56 -38.31 71.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.929 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.62 -49.14 77.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -61.03 -47.72 85.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.917 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.92 -46.01 89.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -36.22 65.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.22 -34.7 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -33.6 76.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 8.9 tt -73.61 -49.39 26.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -50.3 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.68 73.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.108 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.02 -35.83 79.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -65.25 -27.8 68.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.4 -56.6 15.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.58 -48.36 77.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -56.05 -32.28 59.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.493 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.46 71.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.25 -54.24 7.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 0.0 111.121 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -55.75 -28.62 56.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 11.4 tp -56.09 -47.32 78.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.56 58.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.08 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -60.32 -34.16 73.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.51 -47.25 79.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.91 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.51 -47.63 72.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.55 -30.71 71.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.12 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -49.67 20.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.34 87.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.116 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.02 -47.03 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.72 -39.49 91.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.85 -38.03 77.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -34.17 65.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.948 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' SER . . . . . 0.647 ' HB3' HG23 ' B' ' 237' ' ' THR . 8.4 m -57.15 -50.74 71.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.819 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.37 -51.43 60.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.143 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.53 -47.76 72.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.914 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 24.6 p -59.33 -33.71 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.801 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.57 -46.97 88.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.56 -32.26 58.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.6 -20.35 63.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' LYS . . . . . 0.498 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -59.85 -62.82 5.12 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.593 0.711 . . . . 0.0 110.929 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.77 -27.34 26.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.693 2.262 . . . . 0.0 112.352 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.62 -35.59 60.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.126 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.75 -34.87 74.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.954 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -51.05 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -71.25 -34.65 70.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.88 -50.34 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -36.35 83.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -56.81 -48.56 77.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.954 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' GLY . . . . . 0.575 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.64 -29.26 74.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.51 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.03 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.6 OUTLIER -48.77 -60.73 4.13 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.627 0.727 . . . . 0.0 110.938 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.9 Cg_endo -69.75 -38.56 7.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.68 2.253 . . . . 0.0 112.367 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.0 t -58.17 -54.22 35.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -35.0 74.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.91 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' GLU . . . . . 0.627 ' O ' HG13 ' A' ' 227' ' ' VAL . 2.2 mt-10 -63.49 -37.29 86.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.899 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 -45.81 92.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.5 -36.46 68.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.64 -51.78 56.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 227' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 223' ' ' GLU . 30.0 m -57.62 -35.97 52.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.106 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.7 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 230' ' ' LEU . . . . . 0.579 HD13 HD11 ' A' ' 233' ' ' LEU . 2.9 mm? -63.48 -33.71 76.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -31.45 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.79 -51.7 52.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 233' ' ' LEU . . . . . 0.579 HD11 HD13 ' A' ' 230' ' ' LEU . 0.9 OUTLIER -67.9 -46.08 72.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.935 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.47 -36.22 75.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.22 -48.78 72.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -54.04 -39.84 66.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.939 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 237' ' ' THR . . . . . 0.699 HG23 ' HB3' ' B' ' 201' ' ' SER . 78.5 m -65.58 -46.45 79.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -55.07 37.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.867 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -44.85 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.78 -35.03 68.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.907 179.991 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -56.84 16.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.15 -34.96 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -56.65 -51.32 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -32.21 66.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -62.02 -24.86 67.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.12 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -51.06 -33.33 25.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.817 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.15 -26.93 9.71 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.437 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.62 HD23 ' N ' ' B' ' 83' ' ' ARG . 0.0 OUTLIER -47.38 -40.54 17.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.911 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ARG . . . . . 0.62 ' N ' HD23 ' B' ' 82' ' ' LEU . 5.1 mtt-85 -59.58 -49.77 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.26 -47.26 86.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.81 -49.7 67.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -40.05 81.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.878 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 51.4 m -60.08 -50.59 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.83 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.89 -46.28 88.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' ASP . . . . . 0.681 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.0 t0 -55.29 -47.92 74.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.895 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.55 -47.58 81.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.64 -47.45 76.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 -36.65 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.2 t -66.54 -31.23 52.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -53.02 9.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.43 -34.74 75.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -77.86 -33.96 51.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.02 -45.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.149 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.559 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.2 OUTLIER -44.08 -66.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.592 0.71 . . . . 0.0 110.952 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.559 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.81 -30.48 21.99 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.668 2.245 . . . . 0.0 112.313 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.4 t80 -60.89 -24.07 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -76.33 -50.6 13.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -60.99 -34.66 75.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -47.22 72.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -52.4 65.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.96 -47.59 79.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.06 -22.11 66.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 23.2 tptt -72.34 -46.49 55.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.856 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -26.41 63.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -65.98 -59.98 3.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.83 -34.56 78.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.34 -30.42 67.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -68.81 -54.13 17.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -66.65 -34.45 77.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.71 -26.1 54.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' TYR . . . . . 0.655 ' O ' HG23 ' B' ' 119' ' ' VAL . 6.2 t80 -65.85 -54.2 29.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 -33.35 65.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.833 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.408 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 56.6 tt0 -71.57 -24.12 61.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -88.47 -48.68 7.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.906 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' B' ' 115' ' ' TYR . 70.5 t -59.88 -31.54 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.088 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.7 mt-10 -55.59 -64.64 2.01 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.628 0.728 . . . . 0.0 110.88 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.7 Cg_endo -69.81 -52.73 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.71 2.274 . . . . 0.0 112.304 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.47 -63.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.74 -31.25 2.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -77.59 -45.78 24.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 0.0 110.893 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -68.7 -46.64 68.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.94 -51.82 65.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -60.52 -42.14 95.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -66.46 -51.4 57.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -60.86 -32.08 71.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.666 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -64.76 -47.83 76.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -58.81 -45.82 89.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.868 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.3 -33.52 67.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.09 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -69.0 -50.36 49.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' VAL . . . . . 0.666 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.6 p -65.17 -41.13 90.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' ASP . . . . . 0.408 ' N ' HG13 ' B' ' 156' ' ' VAL . 25.7 t70 -53.26 -52.68 58.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -48.73 73.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.076 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.16 -37.92 72.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -44.24 77.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.849 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.71 -42.41 79.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -81.43 -29.77 33.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 35.1 tp -70.86 -18.29 62.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.949 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -59.69 -62.96 4.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.589 0.709 . . . . 0.0 111.123 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.79 -44.0 2.31 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.703 2.269 . . . . 0.0 112.35 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' TYR . . . . . 0.582 ' CE2' HD22 ' B' ' 170' ' ' LEU . 15.8 t80 -58.41 -27.76 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 1.1 m -64.19 -48.74 74.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -62.1 -47.28 85.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.872 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.09 -52.26 56.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' LEU . . . . . 0.582 HD22 ' CE2' ' B' ' 166' ' ' TYR . 17.0 tp -58.47 -48.32 81.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 8.8 mmp_? -56.5 -37.33 70.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -45.34 91.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.89 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -63.73 -47.58 80.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.842 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.28 -43.58 94.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.22 -36.99 69.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.94 -34.62 64.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.135 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -33.57 76.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 9.0 tt -73.49 -48.98 29.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.939 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.59 56.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.86 -49.45 73.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.64 -36.11 81.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.2 -27.73 68.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.922 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.48 -56.29 18.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.66 -46.84 83.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.906 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -57.43 -32.45 64.36 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.7 71.55 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.537 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.14 -54.11 7.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -55.77 -28.57 56.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.97 -47.77 77.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.911 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.66 -48.56 59.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.25 -34.09 73.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.934 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -64.48 -47.28 79.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.923 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.5 -47.85 72.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.86 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.33 -30.71 71.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.064 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -49.76 20.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.07 -39.19 86.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.0 -46.99 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.124 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.99 -39.25 90.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.93 -38.04 78.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.21 -34.22 65.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.946 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 201' ' ' SER . . . . . 0.699 ' HB3' HG23 ' A' ' 237' ' ' THR . 8.4 m -57.1 -50.67 72.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.44 -51.35 60.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.118 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -47.86 72.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.969 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 24.3 p -59.35 -33.53 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.58 -47.01 88.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.915 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -32.41 58.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.49 -20.25 63.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.51 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -60.0 -62.92 4.92 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.589 0.709 . . . . 0.0 110.888 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 209' ' ' PRO . . . . . 0.51 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.2 Cg_endo -69.77 -27.13 26.79 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.717 2.278 . . . . 0.0 112.347 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.81 -35.65 59.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.121 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 18.4 mt -69.66 -34.7 74.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.941 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.47 -50.94 64.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -71.21 -34.79 71.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.72 -50.53 73.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -36.31 83.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -56.76 -48.6 77.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.59 -29.24 74.44 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.526 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 7.9 tp -66.08 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 219' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.6 OUTLIER -48.7 -60.77 4.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 220' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.78 -38.58 7.56 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.677 2.251 . . . . 0.0 112.339 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 47.7 t -58.09 -54.28 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -35.12 74.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 223' ' ' GLU . . . . . 0.628 ' O ' HG13 ' B' ' 227' ' ' VAL . 2.2 mt-10 -63.35 -37.17 86.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.921 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . 0.41 ' O ' HG22 ' B' ' 227' ' ' VAL . 1.5 m -60.51 -45.81 92.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.45 -36.47 68.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.61 -51.76 57.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 227' ' ' VAL . . . . . 0.628 HG13 ' O ' ' B' ' 223' ' ' GLU . 30.9 m -57.6 -35.97 52.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.151 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -51.38 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.72 -38.12 89.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.932 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 230' ' ' LEU . . . . . 0.587 HD13 HD11 ' B' ' 233' ' ' LEU . 2.9 mm? -63.53 -33.68 76.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -31.37 67.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.81 -51.65 53.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 233' ' ' LEU . . . . . 0.587 HD11 HD13 ' B' ' 230' ' ' LEU . 0.9 OUTLIER -67.97 -46.09 72.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.4 -36.36 75.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.12 -48.76 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -53.98 -39.88 66.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 237' ' ' THR . . . . . 0.647 HG23 ' HB3' ' A' ' 201' ' ' SER . 78.3 m -65.6 -46.41 79.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.142 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -55.08 36.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.865 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -44.83 80.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.895 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.74 -35.03 68.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 179.937 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.962 0.41 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.6 p -127.44 44.39 2.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.153 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.08 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -56.91 -43.13 81.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -72.44 -42.95 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -43.31 98.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -43.69 73.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -57.52 -46.94 83.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.659 ' HB2' HG23 ' A' ' 242' ' ' THR . 0.4 OUTLIER -77.75 -27.86 50.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.581 HD22 ' O ' ' A' ' 64' ' ' LEU . 1.1 tm? -54.53 -47.41 73.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.702 ' O ' HG22 ' A' ' 68' ' ' THR . . . 96.73 74.65 1.21 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.52 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -16.02 37.23 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.614 2.209 . . . . 0.0 112.348 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -55.25 -36.18 39.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.159 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.702 HG22 ' O ' ' A' ' 65' ' ' GLY . 8.8 t -58.25 -39.54 79.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.146 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -59.8 -51.25 70.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -66.85 -27.32 67.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.65 -61.68 2.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.854 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 21.4 p-90 -69.7 -32.61 71.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.937 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -67.0 -53.06 35.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.816 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -62.97 -43.96 97.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.919 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.63 -57.5 11.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -58.03 -35.21 70.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.922 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -58.62 -52.07 67.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.94 -32.83 63.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.887 HG22 HD23 ' A' ' 82' ' ' LEU . 95.0 m -62.14 -25.96 68.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.168 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.76 -34.38 27.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.91 -27.76 14.61 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.441 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.887 HD23 HG22 ' A' ' 79' ' ' THR . 2.3 pp -48.62 -37.31 17.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.831 0.348 . . . . 0.0 110.921 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -59.65 -44.71 93.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.93 -49.61 73.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 6.4 mtp -58.16 -41.56 84.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.75 -50.61 73.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.58 -44.34 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.863 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.71 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER -56.5 -47.41 79.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.45 -49.67 75.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -54.34 -47.8 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -65.06 -34.92 79.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.94 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 89' ' ' ASP . 69.3 t -66.41 -32.3 57.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.14 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -74.93 -52.91 10.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.54 -33.65 75.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -77.53 -33.42 54.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -58.67 -43.07 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.136 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 5.6 mm-40 -44.38 -65.05 0.66 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.586 0.708 . . . . 0.0 110.908 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.4 Cg_endo -69.77 -32.27 18.85 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.672 2.248 . . . . 0.0 112.332 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 14.7 t80 -58.94 -25.26 63.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.9 mt -72.5 -50.64 24.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.59 -34.17 77.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -47.74 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.69 -52.22 65.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.74 -45.59 85.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -63.2 -22.61 66.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -73.25 -47.15 45.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -66.88 -28.41 68.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -66.27 -56.46 11.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -70.28 -34.63 73.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -69.44 -32.53 71.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -69.2 -54.2 16.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -35.03 79.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.869 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.64 -26.25 54.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.76 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.0 t80 -63.33 -55.35 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -73.61 -36.02 65.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.851 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 72.6 tp60 -67.93 -22.56 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.909 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -89.07 -36.23 15.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 115' ' ' TYR . 85.5 t -64.86 -32.55 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.9 tt0 -59.56 -61.83 7.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.651 0.739 . . . . 0.0 110.859 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.6 Cg_endo -69.7 -52.32 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.677 2.251 . . . . 0.0 112.395 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 28.4 tp -69.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.89 -32.42 2.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -76.67 -44.66 32.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.814 0.34 . . . . 0.0 110.916 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.71 -42.63 81.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 35.4 mmt -66.82 -47.47 71.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.41 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.3 tpp85 -64.53 -42.94 95.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.8 -52.77 22.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -59.99 -34.9 73.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.844 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.34 -41.67 96.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.099 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -63.27 -48.27 78.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.03 71.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.101 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -69.31 -50.69 44.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.1 p -66.41 -41.58 89.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.463 ' N ' HG13 ' A' ' 156' ' ' VAL . 16.9 t70 -52.85 -52.26 57.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.93 75.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -39.27 74.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.947 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -45.12 75.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.908 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 22.6 m -55.88 -41.83 75.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.69 -31.5 32.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.842 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.13 -22.76 62.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.823 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.63 -62.56 3.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.577 0.703 . . . . 0.0 111.142 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.823 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.5 Cg_endo -69.83 -44.17 2.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -59.13 -31.37 68.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.938 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.8 t -56.71 -52.12 66.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.875 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.59 -47.57 80.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.871 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.8 -51.28 69.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.511 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.0 tm? -58.95 -44.71 91.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.21 -35.57 67.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -50.04 60.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.54 -40.11 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.6 tp -70.0 -49.82 47.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . 0.54 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.92 -34.31 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.114 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.15 -34.22 56.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.125 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -62.11 -49.05 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 175' ' ' ALA . 1.5 pp -66.99 -49.31 65.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.523 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.9 OUTLIER -59.39 -49.59 77.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.884 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.84 -46.8 78.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.86 -39.67 74.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.941 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -67.55 -28.17 67.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.868 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.75 -56.1 20.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.848 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.84 -27.53 65.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.16 -31.25 65.24 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.3 -48.7 66.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.48 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.25 -23.1 38.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.766 0.317 . . . . 0.0 111.054 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.81 -30.53 62.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.816 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.97 -43.62 98.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.8 -48.82 43.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.097 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.94 -50.52 73.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -56.12 -46.7 79.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.919 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.19 -50.73 61.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.844 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.36 -31.01 68.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.123 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.41 -49.09 17.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.861 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.48 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.127 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.0 m -66.58 -48.36 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.147 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 26.3 pt-20 -70.86 -36.1 72.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -58.88 -47.64 84.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 4.4 mp -72.29 -29.8 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 58.0 m -56.91 -51.2 70.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 37.0 p -69.39 -50.35 46.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.151 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.41 -55.57 27.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 61.4 m -54.43 -35.88 63.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.875 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.85 -46.99 86.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -78.35 -27.84 47.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.04 -21.65 63.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.131 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.48 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -62.35 -60.71 9.26 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.561 0.696 . . . . 0.0 110.871 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 54.3 Cg_endo -69.72 -28.34 25.55 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.685 2.257 . . . . 0.0 112.366 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.78 -31.59 57.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.15 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.8 -38.39 73.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -54.19 -50.57 66.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.03 -31.18 58.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.849 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.59 -52.11 66.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -35.57 78.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.848 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -57.2 -48.91 77.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.866 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.82 -29.79 72.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.481 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.36 -32.4 73.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.924 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 0.8 OUTLIER -52.48 -61.65 4.31 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.595 0.712 . . . . 0.0 110.896 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.78 -43.79 2.44 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.661 2.241 . . . . 0.0 112.364 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 217' ' ' GLY . 57.0 t -57.2 -55.08 22.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.14 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.73 -33.19 71.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.621 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -68.43 -34.98 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.92 83.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.858 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -65.6 -42.57 91.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.34 -44.84 90.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 223' ' ' GLU . 42.9 t -55.54 -42.69 69.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.102 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -49.82 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -65.08 -38.5 90.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 233' ' ' LEU . 2.3 mm? -64.96 -34.05 77.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.21 -30.98 65.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.88 56.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.069 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -67.18 -36.54 81.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.945 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.16 -35.97 69.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.78 -49.14 32.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.87 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.31 -37.27 80.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 97.9 m -71.04 -46.37 62.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.161 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -56.46 -53.93 51.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.87 -48.79 78.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.9 -34.53 69.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -72.97 -26.46 61.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . 0.659 HG23 ' HB2' ' A' ' 63' ' ' GLN . 2.0 m 73.92 -68.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.949 0.404 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 29.3 p -128.01 44.43 2.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.159 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -128.24 -67.42 0.81 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.7 m -56.99 -43.1 81.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.859 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -72.45 -43.0 64.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.97 -43.24 99.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.91 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.16 -43.81 73.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.847 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -57.42 -47.0 82.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.727 ' HB2' HG23 ' B' ' 242' ' ' THR . 0.4 OUTLIER -77.71 -27.91 50.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.586 ' O ' HD22 ' B' ' 64' ' ' LEU . 1.1 tm? -54.59 -47.32 73.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . 0.697 ' O ' HG22 ' B' ' 68' ' ' THR . . . 96.69 74.58 1.21 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.505 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -16.2 37.68 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.668 2.245 . . . . 0.0 112.361 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.14 -36.07 37.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.173 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . 0.697 HG22 ' O ' ' B' ' 65' ' ' GLY . 8.7 t -58.34 -39.57 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -59.74 -51.31 70.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -66.86 -27.36 67.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -61.53 -61.75 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 21.8 p-90 -69.7 -32.63 71.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.897 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -66.94 -53.02 35.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.825 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -63.03 -44.05 96.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.925 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.45 -57.47 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.946 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.12 -35.3 71.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -58.47 -52.2 66.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -32.81 63.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . 0.861 HG22 HD23 ' B' ' 82' ' ' LEU . 95.3 m -62.09 -25.92 67.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.168 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -34.39 27.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.9 -27.71 14.43 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.488 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.861 HD23 HG22 ' B' ' 79' ' ' THR . 2.4 pp -48.7 -37.51 18.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.778 0.323 . . . . 0.0 110.913 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.64 -49.78 76.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.883 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -59.68 -44.87 93.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.92 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -55.73 -49.71 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 6.3 mtp -58.26 -41.42 84.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 5.1 m -58.79 -50.58 73.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.89 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -58.64 -44.43 90.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.2 OUTLIER -56.28 -47.82 77.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.37 -49.39 76.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.35 -47.4 72.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.929 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.68 -34.95 79.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.9 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' B' ' 89' ' ' ASP . 76.1 t -66.48 -32.15 56.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.159 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -75.5 -53.29 8.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.91 75.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.104 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -77.76 -33.69 52.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.881 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -55.43 -46.43 78.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.561 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 5.2 mm-40 -43.48 -66.24 0.47 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.576 0.703 . . . . 0.0 110.913 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.561 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.73 -31.46 20.62 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 0.0 112.349 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.441 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.5 t80 -58.66 -24.7 61.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.88 -50.14 15.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.929 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.83 -34.38 73.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.69 -47.56 69.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -56.09 -52.61 63.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.31 -46.16 84.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -62.2 -22.56 66.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.872 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -72.95 -47.41 45.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.89 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.86 -30.82 71.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -63.98 -56.4 15.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.14 -34.29 72.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -70.57 -31.68 68.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.904 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . 0.41 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 1.2 tmt? -69.95 -54.48 13.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.15 -35.52 81.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.51 -25.94 54.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.953 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.9 t80 -63.13 -55.57 24.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.932 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -74.43 -33.94 63.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.443 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 72.6 tp60 -69.58 -21.93 63.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -91.24 -36.31 13.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 97.2 t -65.68 -32.62 58.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.475 ' N ' ' HD2' ' B' ' 143' ' ' PRO . 2.8 tt0 -60.67 -61.45 7.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.672 0.749 . . . . 0.0 110.89 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.75 -51.54 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.342 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 23.3 tp -70.84 -64.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.4 -32.21 1.76 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.462 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -77.74 -47.32 19.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 110.882 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 -45.68 78.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.5 mmt -64.91 -51.94 59.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.836 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.7 tpp85 -60.29 -43.59 96.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -66.75 -51.69 52.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.848 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.49 -31.91 70.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.655 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.48 -47.27 76.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.088 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 12.8 tpt85 -59.16 -45.3 91.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.65 -34.19 67.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.133 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . 0.438 ' CE1' HD13 ' B' ' 159' ' ' LEU . 49.1 t-80 -68.87 -50.05 53.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.83 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.655 HG12 ' O ' ' B' ' 152' ' ' ALA . 8.7 p -65.23 -41.36 91.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . 0.426 ' N ' HG13 ' B' ' 156' ' ' VAL . 17.1 t70 -53.06 -51.95 60.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.05 -48.55 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.438 HD13 ' CE1' ' B' ' 155' ' ' HIS . 0.2 OUTLIER -57.37 -37.93 73.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -44.96 74.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 22.8 m -56.15 -41.86 76.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.164 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -81.56 -31.14 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.3 tt -70.87 -22.64 62.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.837 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.84 -62.52 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.577 0.703 . . . . 0.0 111.121 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.837 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.76 -42.43 3.41 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.71 2.273 . . . . 0.0 112.35 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -60.74 -31.16 70.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.943 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.7 t -57.4 -51.85 67.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.829 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.23 -47.64 81.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.27 -51.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.877 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.512 ' O ' HD22 ' B' ' 170' ' ' LEU . 2.0 tm? -58.86 -44.45 91.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -56.36 -36.07 68.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -49.44 64.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -64.25 -41.47 96.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 25.1 tp -69.27 -48.94 60.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.939 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . 0.534 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.1 -34.34 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.102 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.41 57.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.124 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -61.98 -48.89 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' B' ' 175' ' ' ALA . 1.6 pp -67.32 -48.96 66.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . 0.53 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.9 OUTLIER -59.3 -50.32 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.893 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.61 77.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.063 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.9 tt -57.13 -39.39 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -68.3 -28.23 67.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 -55.76 23.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.854 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -58.92 -27.38 65.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -58.24 -31.41 65.8 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -65.18 -48.81 66.09 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.473 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.15 -23.18 38.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.769 0.318 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -73.72 -30.53 62.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.839 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -43.77 98.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.84 -48.68 44.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.117 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.96 -50.41 73.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.873 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -56.38 -46.69 79.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -52.17 -50.22 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.85 -30.97 69.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.095 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -76.3 -48.95 18.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.26 -34.12 76.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.1 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.4 m -65.87 -48.66 70.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -70.91 -36.15 72.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.82 -47.56 84.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.37 -29.75 64.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.926 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 57.7 m -56.98 -51.09 70.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.848 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 36.6 p -69.37 -50.27 47.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.158 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.6 tp -54.49 -55.58 27.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.879 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 61.3 m -54.51 -35.85 63.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.835 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.87 -46.88 86.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.888 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -78.47 -27.83 46.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -70.11 -21.74 63.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.485 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -62.27 -60.75 9.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.554 0.692 . . . . 0.0 110.901 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.8 -28.25 25.28 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.711 2.274 . . . . 0.0 112.333 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.95 -31.55 56.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.126 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.6 tt -70.62 -38.5 73.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.926 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -54.12 -50.43 66.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -75.88 -31.11 59.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.72 -52.22 66.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -35.46 78.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -57.21 -48.87 77.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.491 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.89 -29.82 72.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.493 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.31 -32.47 73.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.8 OUTLIER -52.45 -61.67 4.27 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.616 0.722 . . . . 0.0 110.923 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 54.0 Cg_endo -69.73 -43.83 2.45 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 0.0 112.398 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.491 HG23 ' O ' ' B' ' 217' ' ' GLY . 56.6 t -57.23 -55.11 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.171 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -33.32 71.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.632 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.4 mt-10 -68.45 -34.92 76.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.906 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -47.96 83.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.856 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -65.64 -42.4 91.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -64.42 -44.9 89.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.867 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.632 HG23 ' O ' ' B' ' 223' ' ' GLU . 43.0 t -55.53 -42.67 69.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.14 -49.82 76.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -65.1 -38.53 91.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.508 HD13 HD11 ' B' ' 233' ' ' LEU . 2.3 mm? -64.87 -34.09 77.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.907 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 58.3 m -72.26 -30.91 65.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.55 -50.75 57.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.508 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -67.31 -36.42 81.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.2 -36.06 69.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -72.73 -49.13 33.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.877 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -60.35 -37.24 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.925 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 98.1 m -70.99 -46.44 62.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.169 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 7.1 ttmt -56.45 -53.9 51.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -61.84 -48.81 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 29.6 mt -57.92 -34.55 69.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.925 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -72.84 -26.51 61.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . 0.727 HG23 ' HB2' ' B' ' 63' ' ' GLN . 2.0 m 73.88 -67.95 0.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.126 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.896 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.7 m . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.958 0.408 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -135.34 -71.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.109 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 56.24 44.83 24.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.8 t -61.59 -41.52 97.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.862 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -35.9 74.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.871 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.14 -42.48 96.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.956 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.98 -46.71 61.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.35 -38.99 92.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.911 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -78.04 -28.32 48.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.582 HD22 ' O ' ' A' ' 64' ' ' LEU . 1.2 tm? -52.55 -48.79 65.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.938 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.462 ' N ' HD13 ' A' ' 64' ' ' LEU . . . 94.1 73.64 1.22 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.5 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -25.54 28.8 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.685 2.257 . . . . 0.0 112.379 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.421 HG23 ' N ' ' A' ' 68' ' ' THR . 16.5 m -56.37 -44.08 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.137 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.421 ' N ' HG23 ' A' ' 67' ' ' VAL . 61.3 p -70.64 -57.33 4.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -41.37 64.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.867 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.48 -32.32 66.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.883 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -53.53 56.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -73.08 -44.48 60.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.901 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -56.87 -52.28 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -66.72 -41.39 87.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.819 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' A' ' 79' ' ' THR . 35.1 tp -59.85 -55.26 36.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.948 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.61 -33.81 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.885 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.18 -49.4 74.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.54 -34.01 76.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 75' ' ' LEU . 28.8 p -73.11 -23.45 60.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -50.96 -31.96 19.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.32 -30.7 40.95 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 79' ' ' THR . 2.6 pp -51.67 -36.88 48.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.35 -49.67 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.876 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.23 -41.73 98.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -58.04 -48.08 81.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.3 mmt -62.5 -40.09 95.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -58.76 -50.24 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.869 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -60.56 -46.24 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.89 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 20.3 t70 -55.62 -47.59 76.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.888 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tp -58.15 -50.85 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.08 66.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.836 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -62.64 -37.96 88.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.893 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 96.2 t -65.34 -31.68 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.138 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -74.93 -53.93 8.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.895 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.57 -30.67 71.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.121 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.96 -36.11 42.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.34 -43.33 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.187 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.551 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.9 mm-40 -44.33 -65.23 0.64 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.61 0.719 . . . . 0.0 110.943 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.551 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.9 Cg_endo -69.8 -27.27 26.46 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -53.72 -57.29 11.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.628 HD23 ' HB3' ' B' ' 160' ' ' ARG . 1.7 mp -53.65 -29.13 36.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.929 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.82 -47.04 73.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.04 -42.83 93.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -50.74 72.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.883 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -47.5 85.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -26.2 68.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -45.79 67.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.868 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -23.17 61.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -66.21 -64.83 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -63.4 -34.78 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.892 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -70.51 -30.07 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.874 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.408 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 1.2 tmt? -65.65 -51.64 57.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.852 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -40.67 96.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -25.34 56.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.773 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.6 t80 -61.92 -54.97 34.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -71.18 -39.26 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.854 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -65.28 -25.67 67.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.35 -40.91 12.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.9 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 115' ' ' TYR . 59.0 t -57.61 -31.76 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.544 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.9 mt-10 -60.12 -65.09 2.31 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.587 0.708 . . . . 0.0 110.868 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.544 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 54.1 Cg_endo -69.73 -51.42 0.39 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.714 2.276 . . . . 0.0 112.374 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -63.61 1.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.907 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.18 -31.84 1.48 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.481 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -75.37 -43.58 49.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 0.0 110.857 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -71.83 -37.37 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -67.54 -47.74 69.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.834 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.403 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 9.3 tpp180 -66.31 -39.92 89.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.87 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -71.37 -51.34 24.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -62.46 -38.27 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.22 -42.47 99.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.067 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.79 -50.91 70.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -69.52 -32.05 70.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.084 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.16 -50.6 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.832 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 10.7 p -67.34 -35.53 74.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.129 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -57.3 -51.25 70.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.01 56.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.087 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 22.2 tp -56.76 -42.57 79.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.587 ' HB3' HD23 ' B' ' 101' ' ' LEU . 0.6 OUTLIER -68.47 -38.88 81.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.88 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 61.8 m -56.95 -47.61 80.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.09 -34.9 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.87 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 31.3 tp -72.31 -15.08 61.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.922 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.815 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -62.3 -62.05 6.5 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.609 0.719 . . . . 0.0 111.15 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.815 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.73 -39.4 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.364 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -63.16 -34.22 77.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.928 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.95 -48.58 73.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -62.02 -49.39 76.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.46 -51.07 68.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.886 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 31.7 tp -60.62 -50.04 75.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.57 -34.01 76.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.833 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.23 79.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.967 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -49.02 38.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.867 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -51.47 47.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.31 -43.02 74.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.109 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.95 -39.35 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.05 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.95 -33.43 75.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.887 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.76 -50.17 26.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.39 -50.93 57.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.27 76.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.086 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 18.8 tp -63.79 -34.78 78.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -65.28 -33.54 76.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.82 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.53 -45.16 77.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -67.56 -26.28 66.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.12 -33.57 37.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.445 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.1 -32.3 35.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.502 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.25 -25.74 42.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 111.133 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.75 -35.25 65.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -37.18 86.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.907 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.33 38.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.063 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -49.08 77.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.47 -42.69 92.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.928 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.84 -50.16 66.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.96 -30.92 70.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.088 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.36 -49.73 18.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.66 -34.82 77.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.156 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.1 m -64.23 -47.67 78.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.14 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.87 -37.77 79.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -42.85 90.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.858 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -30.95 64.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 20.3 m -57.18 -51.02 70.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.865 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 4.8 p -67.74 -50.38 57.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.159 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.0 tp -55.06 -53.06 60.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 14.1 m -54.64 -36.17 64.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.814 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -46.27 88.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -28.85 48.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.896 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.08 62.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.489 ' N ' ' HD2' ' A' ' 209' ' ' PRO . 4.4 tptt -61.07 -60.37 10.85 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.589 0.709 . . . . 0.0 110.893 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.71 -29.16 24.54 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.694 2.263 . . . . 0.0 112.41 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.54 -29.82 56.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.085 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.0 tt -72.54 -38.66 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.91 -51.22 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.883 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.75 -31.25 61.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.4 HD23 ' N ' ' A' ' 215' ' ' ARG . 4.7 tt -62.91 -52.46 62.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.95 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . 0.4 ' N ' HD23 ' A' ' 214' ' ' LEU . 36.7 ttp180 -63.7 -37.76 88.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.874 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -56.67 -48.32 77.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.75 -29.25 74.42 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.457 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.88 -33.07 74.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.836 0.351 . . . . 0.0 110.883 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.1 mp -48.3 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.583 0.706 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.2 Cg_endo -69.78 -37.72 8.74 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.683 2.255 . . . . 0.0 112.324 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 217' ' ' GLY . 47.2 t -58.55 -54.87 27.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.172 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -34.98 74.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.6 OUTLIER -65.22 -34.62 78.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.15 -48.43 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.31 -43.18 70.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -62.49 -48.86 77.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.828 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 223' ' ' GLU . 24.9 t -56.74 -38.78 59.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.56 -50.1 75.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.865 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.78 -38.48 90.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.825 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.762 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -65.22 -34.76 79.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 10.8 m -70.14 -30.42 67.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.829 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.16 48.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.123 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.762 HD11 HD13 ' A' ' 230' ' ' LEU . 1.5 pp -69.2 -38.99 78.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.65 -39.65 84.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -72.26 -48.62 41.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.7 -35.89 69.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 93.9 m -70.73 -47.33 60.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.109 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -53.79 52.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -61.73 -48.72 79.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.94 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.83 -35.09 70.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -69.01 -28.95 67.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.53 -68.18 0.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.182 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.922 179.972 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.943 0.402 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -135.5 -71.38 0.47 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.117 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 56.32 44.93 23.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.859 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 12.8 t -61.65 -41.59 97.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.825 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.21 -35.88 74.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -42.38 96.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.98 -46.76 61.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.865 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.3 -39.01 93.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -78.04 -28.37 48.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.591 ' O ' HD22 ' B' ' 64' ' ' LEU . 1.2 tm? -52.44 -48.92 65.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.942 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . 0.46 ' N ' HD13 ' B' ' 64' ' ' LEU . . . 94.19 73.6 1.21 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.485 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -25.38 28.4 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.628 2.219 . . . . 0.0 112.353 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . 0.428 HG23 ' N ' ' B' ' 68' ' ' THR . 16.5 m -56.36 -44.01 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.139 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . 0.428 ' N ' HG23 ' B' ' 67' ' ' VAL . 60.6 p -70.78 -57.29 4.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.129 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.96 -41.27 64.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.933 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.47 -32.41 66.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.886 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -53.48 57.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.865 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -73.12 -44.43 60.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -56.91 -52.22 66.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.918 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -66.7 -41.38 88.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.698 ' O ' HG23 ' B' ' 79' ' ' THR . 35.0 tp -59.86 -55.34 35.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.52 -33.82 76.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.876 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -49.51 73.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.46 -34.05 76.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.877 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . 0.698 HG23 ' O ' ' B' ' 75' ' ' LEU . 28.8 p -73.14 -23.4 60.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.03 -31.93 19.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.893 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.42 -30.7 41.79 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.476 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.504 HD23 ' O ' ' B' ' 79' ' ' THR . 2.5 pp -51.65 -36.79 47.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -58.49 -49.61 76.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -62.11 -42.01 98.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.923 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.74 -48.39 79.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.2 mmt -62.27 -40.0 94.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 44.4 m -58.63 -50.23 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.835 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -60.45 -46.52 89.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.709 ' O ' HG23 ' B' ' 93' ' ' VAL . 20.3 t70 -55.44 -47.97 75.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.891 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.86 -50.78 72.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.11 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.12 -36.66 84.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.925 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.709 HG23 ' O ' ' B' ' 89' ' ' ASP . 97.3 t -66.45 -31.76 55.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -75.21 -54.93 6.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.18 72.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -78.68 -36.57 43.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -54.22 -47.45 67.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.108 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.57 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.0 mm-40 -42.68 -66.76 0.39 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.562 0.696 . . . . 0.0 110.904 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.57 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.69 -24.32 30.12 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.703 2.268 . . . . 0.0 112.339 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -53.54 -54.98 29.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.941 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.587 HD23 ' HB3' ' A' ' 160' ' ' ARG . 0.3 OUTLIER -59.46 -28.36 66.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.87 -48.49 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.848 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.28 -43.94 84.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -51.54 67.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.877 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -47.52 85.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.25 -25.48 64.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.97 -48.93 41.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.918 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -25.63 67.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -68.02 -66.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -60.9 -35.51 76.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.858 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -70.96 -29.3 65.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.902 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . 0.403 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 0.8 OUTLIER -65.49 -51.37 60.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.826 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -39.11 93.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -25.72 56.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.895 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.726 ' O ' HG23 ' B' ' 119' ' ' VAL . 17.6 t80 -64.23 -55.58 20.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.974 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -69.4 -38.61 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -66.6 -24.51 66.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -91.79 -42.56 10.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.726 HG23 ' O ' ' B' ' 115' ' ' TYR . 62.2 t -56.98 -31.47 36.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.527 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mt-10 -61.45 -64.85 2.61 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.649 0.738 . . . . 0.0 110.904 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.527 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.4 Cg_endo -69.74 -51.82 0.36 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -63.95 1.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.99 -31.0 1.11 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.507 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -77.2 -45.21 27.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -70.24 -43.84 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 34.6 mmt -64.9 -51.2 63.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.408 ' HG3' ' HG3' ' A' ' 112' ' ' MET . 10.3 tpp180 -62.09 -41.09 97.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.857 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -68.31 -50.92 50.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.815 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -62.26 -33.73 75.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.57 -49.68 72.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.09 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -56.66 -49.54 74.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.897 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.99 -32.93 72.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.106 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -67.5 -50.15 60.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.837 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.3 -35.55 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.13 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -57.6 -50.78 72.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.1 58.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.109 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 22.0 tp -57.37 -42.21 81.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . 0.628 ' HB3' HD23 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -67.64 -39.54 84.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 86.1 m -57.25 -46.88 82.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -78.48 -34.94 47.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 31.6 tp -72.4 -15.37 61.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.93 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.794 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -62.13 -61.96 6.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.582 0.706 . . . . 0.0 111.076 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.794 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.73 -38.7 7.5 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -63.86 -34.95 79.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -64.02 -48.37 76.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -62.2 -49.24 76.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.867 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.4 -51.16 68.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.912 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.61 -50.1 74.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -63.35 -33.9 76.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -35.33 80.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -48.82 41.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.38 48.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.888 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.56 -42.75 75.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.04 -39.11 63.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.142 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -34.15 77.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.892 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 178' ' ' LEU . 0.4 OUTLIER -72.52 -49.35 33.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -67.19 -50.48 60.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.71 80.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 19.1 tp -64.36 -34.51 78.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -66.62 -33.77 76.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -44.71 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.875 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -68.05 -26.09 65.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.09 -33.59 37.7 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.482 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.0 -32.38 34.58 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.459 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.68 42.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.339 . . . . 0.0 111.128 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -73.73 -35.69 65.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -37.35 86.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.85 -49.25 39.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.137 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -48.44 79.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.88 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.92 -42.83 94.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -53.88 -49.99 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.83 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.07 -30.91 70.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.129 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.5 tmtt? -75.53 -49.6 18.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.71 -35.03 78.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.094 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 63.5 m -64.16 -47.56 79.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.163 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -68.85 -37.88 79.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.847 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -42.74 90.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.849 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.0 -30.9 64.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 20.2 m -57.28 -50.95 71.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 4.9 p -67.68 -50.38 57.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 8.9 tp -55.09 -53.04 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 13.9 m -54.71 -36.12 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.828 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -46.23 88.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.859 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.13 -28.78 48.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.15 62.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.494 ' N ' ' HD2' ' B' ' 209' ' ' PRO . 4.5 tptt -61.12 -60.3 11.06 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.564 0.697 . . . . 0.0 110.876 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' B' ' 208' ' ' LYS . 53.7 Cg_endo -69.8 -29.17 24.09 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.663 2.242 . . . . 0.0 112.3 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -29.76 56.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.109 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.39 -38.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.84 -51.03 64.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -74.81 -31.27 61.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.84 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.413 HD23 ' N ' ' B' ' 215' ' ' ARG . 4.7 tt -62.93 -52.45 62.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.919 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . 0.413 ' N ' HD23 ' B' ' 214' ' ' LEU . 36.5 ttp180 -63.88 -37.6 88.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -56.64 -48.4 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.581 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.79 -29.3 74.49 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.482 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.74 -33.13 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.886 0.374 . . . . 0.0 110.956 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.1 mp -48.28 -60.79 3.87 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 0.0 110.916 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.8 Cg_endo -69.72 -37.72 8.88 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.675 2.25 . . . . 0.0 112.328 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.581 HG23 ' O ' ' B' ' 217' ' ' GLY . 46.3 t -58.65 -54.81 28.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.51 -35.12 75.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.465 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.6 OUTLIER -65.15 -34.61 78.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.844 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.9 m -62.18 -48.46 79.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.789 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -70.27 -43.21 70.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.879 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.1 tttm -62.49 -48.83 77.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 223' ' ' GLU . 24.8 t -56.69 -38.82 59.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.167 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 39.9 t -58.55 -50.13 74.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.82 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.72 -38.48 90.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.907 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.765 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -65.23 -34.82 79.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.937 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 10.4 m -70.05 -30.41 67.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.45 -50.22 47.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.765 HD11 HD13 ' B' ' 230' ' ' LEU . 1.5 pp -69.12 -39.03 79.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.908 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -67.62 -39.56 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.33 -48.62 40.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -56.66 -35.92 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 93.5 m -70.67 -47.35 60.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -53.76 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -61.82 -48.63 79.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 28.0 mt -57.86 -35.06 70.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.921 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -69.01 -29.04 67.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.63 -68.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.152 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.888 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.935 0.398 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -142.31 85.0 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.195 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -103.43 179.73 4.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.843 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -39.2 65.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.933 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -68.46 -43.66 76.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.889 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.447 ' O ' HD23 ' A' ' 64' ' ' LEU . 4.8 mt -69.66 -35.6 75.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.973 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 mtt180 -66.78 -50.51 62.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.853 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.52 -37.76 83.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.91 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.62 -25.73 60.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.955 HD12 HG11 ' A' ' 67' ' ' VAL . 0.2 OUTLIER -53.53 -39.56 64.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.873 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' A' ' 67' ' ' VAL . . . 106.47 -161.86 13.96 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.453 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 33.05 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.674 2.249 . . . . 0.0 112.307 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.955 HG11 HD12 ' A' ' 64' ' ' LEU . 17.7 m -75.81 -30.28 21.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -43.52 -38.49 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -58.28 -50.02 75.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.925 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.29 -32.89 74.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -62.69 -54.92 31.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.59 -34.86 78.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.946 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.77 -54.13 17.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.861 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -65.02 -41.66 95.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.74 -55.13 36.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.916 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.31 -38.29 73.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.03 -51.66 67.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.889 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -30.72 61.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.959 HG22 HD23 ' A' ' 82' ' ' LEU . 91.4 m -59.25 -22.08 60.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.169 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.01 -34.52 13.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.88 -27.15 20.11 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.469 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.959 HD23 HG22 ' A' ' 79' ' ' THR . 2.0 pp -48.31 -35.65 12.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.801 0.334 . . . . 0.0 110.893 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -50.22 74.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.13 -43.81 98.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.41 -49.28 74.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.63 -41.58 86.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -58.62 -50.6 73.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.837 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.83 -45.08 90.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.7 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.16 -46.84 79.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.865 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.23 -50.39 73.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.78 -48.27 69.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.68 -35.57 81.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.886 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 89' ' ' ASP . 63.2 t -65.62 -32.29 57.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.162 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.39 -52.77 11.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.73 -33.27 73.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.088 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -78.03 -33.15 51.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.7 t -58.82 -42.68 86.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.178 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.0 mt-30 -44.6 -64.89 0.71 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.592 0.71 . . . . 0.0 110.918 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.8 -32.9 17.52 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.717 2.278 . . . . 0.0 112.317 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.413 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 15.7 t80 -59.11 -25.22 63.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -73.1 -50.88 20.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.8 -32.52 73.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.896 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -47.4 65.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.913 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -56.09 -52.41 64.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.875 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.23 -47.54 76.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -61.0 -22.75 64.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.919 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -74.32 -45.98 43.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -30.53 71.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -66.18 -55.88 14.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -69.65 -34.46 74.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.94 -31.73 68.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.03 -54.24 16.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.897 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.51 -35.13 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.62 -25.91 54.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.786 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -65.25 -54.62 26.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.964 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.72 -41.31 65.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.403 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 39.3 tt0 -62.01 -25.81 67.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -84.81 -39.23 18.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 115' ' ' TYR . 84.9 t -59.45 -32.49 48.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.157 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.541 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 4.7 mt-10 -57.61 -64.78 2.28 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.645 0.736 . . . . 0.0 110.921 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.8 Cg_endo -69.74 -51.14 0.4 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.699 2.266 . . . . 0.0 112.356 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.2 tp -67.27 -64.3 0.88 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -45.23 -32.67 3.68 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.451 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -74.36 -43.84 54.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -70.89 -35.49 72.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.899 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -49.96 64.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -68.12 -37.13 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.879 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -71.24 -53.57 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -61.44 -37.05 82.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.848 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.577 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -63.77 -40.22 96.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.113 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.401 ' HG3' ' CH2' ' B' ' 108' ' ' TRP . 0.0 OUTLIER -63.02 -49.65 73.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.99 -32.39 69.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.098 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -69.82 -50.87 38.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 152' ' ' ALA . 11.4 p -67.09 -41.55 87.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.131 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.46 ' N ' HG13 ' A' ' 156' ' ' VAL . 6.3 t70 -53.33 -52.63 58.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.31 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.109 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 163' ' ' LEU . 2.1 mp -56.77 -45.3 82.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -63.31 -44.09 95.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.882 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 32.2 m -56.09 -40.78 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.41 -31.23 33.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 159' ' ' LEU . 1.8 mm? -69.34 -22.27 63.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.899 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.812 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.97 -62.7 3.81 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.549 0.69 . . . . 0.0 111.114 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.812 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.7 Cg_endo -69.83 -45.85 1.4 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.67 2.247 . . . . 0.0 112.347 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.55 -29.13 64.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -52.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.836 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.86 -33.18 75.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.839 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.71 -51.91 30.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.846 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.29 -49.34 64.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.88 -35.95 69.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.87 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -41.9 82.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 52.1 ttt180 -72.31 -40.52 67.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.865 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -50.56 38.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.928 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.62 -40.96 80.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.092 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.1 -41.83 61.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.099 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -65.72 -34.15 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.558 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -69.54 -50.07 48.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.558 ' N ' HD23 ' A' ' 178' ' ' LEU . 77.1 mt-10 -69.4 -35.57 75.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.13 -49.17 53.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.125 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.9 -43.15 81.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -70.28 -30.86 67.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.881 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -55.48 31.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.85 -26.79 68.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.74 -34.47 44.39 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.485 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.69 -33.3 41.61 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.498 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.39 42.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.32 . . . . 0.0 111.092 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -73.1 -32.67 65.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.858 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.427 HD22 ' CD2' ' B' ' 72' ' ' TRP . 0.1 OUTLIER -62.36 -39.49 93.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.958 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.38 35.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.08 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -49.56 75.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -57.99 -44.24 87.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -53.64 -49.37 68.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.878 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.41 -31.3 70.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.096 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -49.6 16.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.57 -34.7 78.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.114 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . 0.602 HG21 HD22 ' B' ' 240' ' ' LEU . 86.1 m -65.76 -47.57 74.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.148 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.44 -36.16 76.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.87 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.91 -46.44 87.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.837 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -30.13 64.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.03 -51.11 70.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.813 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.64 -50.59 50.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.32 -55.07 32.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.913 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 68.1 m -54.23 -36.03 63.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.84 -46.53 87.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -29.83 52.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.38 -21.89 64.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.11 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.506 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 2.1 mttt -60.93 -63.08 4.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.562 0.696 . . . . 0.0 110.921 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.2 Cg_endo -69.78 -26.82 27.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.355 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.04 57.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' A' ' 211' ' ' LEU . 2.8 tm? -72.07 -37.18 69.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.25 -50.85 66.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -31.06 57.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.838 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.44 -50.93 70.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . 0.426 ' HD3' HD21 ' A' ' 211' ' ' LEU . 0.0 OUTLIER -68.37 -35.84 78.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.89 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -57.06 -48.94 77.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.49 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.97 -29.78 72.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.459 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -32.66 74.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.85 0.357 . . . . 0.0 110.891 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.475 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -52.34 -61.67 4.23 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 53.3 Cg_endo -69.8 -43.85 2.38 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.28 . . . . 0.0 112.332 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 217' ' ' GLY . 54.1 t -57.27 -55.2 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.128 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.65 -33.25 71.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.955 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.631 ' O ' HG23 ' A' ' 227' ' ' VAL . 5.0 mt-10 -68.56 -34.86 76.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 70.6 m -59.96 -47.87 84.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -66.01 -41.93 90.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -45.13 87.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.93 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 223' ' ' GLU . 44.3 t -55.38 -42.82 69.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.152 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -49.94 75.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.841 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -64.78 -37.59 88.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.861 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.596 HD13 HD11 ' A' ' 233' ' ' LEU . 1.6 mm? -64.93 -34.52 78.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.08 -30.48 65.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -68.02 -50.84 53.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.109 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.596 HD11 HD13 ' A' ' 230' ' ' LEU . 1.4 pp -67.43 -35.57 79.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.05 -39.51 69.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.91 -49.2 31.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -57.71 -41.44 81.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.966 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 80.5 m -65.8 -45.56 81.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.118 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.74 53.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 10.8 mtmm -57.78 -49.55 76.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.926 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.607 HD22 HG21 ' B' ' 197' ' ' THR . 0.5 OUTLIER -58.36 -35.11 71.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -70.31 -29.46 66.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.61 -68.19 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.102 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.894 -179.983 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.93 0.395 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 26.6 m -142.34 85.06 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.157 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -103.66 -179.88 4.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -39.15 64.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.876 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -68.44 -43.66 76.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.453 ' O ' HD23 ' B' ' 64' ' ' LEU . 4.7 mt -69.72 -35.62 75.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -66.72 -50.71 61.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.29 -37.87 84.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.87 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.419 ' CA ' ' HB1' ' B' ' 232' ' ' ALA . 1.0 OUTLIER -73.63 -25.75 60.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 -179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.961 HD12 HG11 ' B' ' 67' ' ' VAL . 0.2 OUTLIER -53.53 -39.6 64.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.922 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' B' ' 67' ' ' VAL . . . 106.51 -162.0 13.89 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.508 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 33.01 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.717 2.278 . . . . 0.0 112.382 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . 0.961 HG11 HD12 ' B' ' 64' ' ' LEU . 18.2 m -75.82 -30.27 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 3.1 t -43.44 -38.59 2.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -58.26 -50.0 75.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -62.65 -54.73 35.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.87 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . 0.427 ' CD2' HD22 ' A' ' 189' ' ' LEU . 0.1 OUTLIER -63.68 -34.87 78.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.71 -54.15 17.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.847 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.04 -41.62 95.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.903 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.77 -55.16 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -57.28 -38.3 73.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.04 -51.5 67.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.908 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . 0.989 HG22 HD23 ' B' ' 82' ' ' LEU . 93.9 m -59.23 -21.96 60.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.141 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -49.24 -34.46 15.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.98 -27.15 20.96 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.509 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.989 HD23 HG22 ' B' ' 79' ' ' THR . 2.0 pp -48.39 -35.44 12.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 110.903 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -50.23 74.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -43.82 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.902 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -56.34 -49.33 74.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 12.7 mmt -58.74 -41.34 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.93 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 11.2 t -58.72 -50.48 73.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -58.92 -45.42 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.706 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -55.76 -47.04 77.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -50.21 73.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -48.12 70.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.866 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -64.81 -35.6 81.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.841 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 89' ' ' ASP . 67.9 t -65.68 -32.34 57.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -74.83 -53.07 9.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.893 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 -34.65 74.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.074 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -77.96 -33.48 51.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.909 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.94 -45.68 80.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.105 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.566 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.9 mt-30 -43.68 -66.16 0.49 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.915 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.566 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 54.0 Cg_endo -69.8 -32.48 18.34 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.33 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.419 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.0 t80 -58.76 -24.27 61.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.41 -50.07 15.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -59.87 -32.51 70.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.865 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.22 -47.11 62.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -55.84 -53.1 60.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.48 -47.66 78.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -60.87 -22.38 64.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -73.51 -47.54 40.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.401 ' CH2' ' HG3' ' A' ' 153' ' ' ARG . 0.1 OUTLIER -63.78 -31.81 73.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -64.03 -56.15 17.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.909 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -70.47 -34.26 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.73 -32.43 69.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -54.21 15.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.841 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.97 -35.6 81.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.67 -25.65 53.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.935 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.772 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.6 t80 -65.16 -54.84 23.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.13 -37.72 66.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -65.62 -24.35 67.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.923 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -88.02 -40.11 14.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.772 HG23 ' O ' ' B' ' 115' ' ' TYR . 94.5 t -60.11 -32.75 51.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.153 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 4.7 mt-10 -58.45 -64.52 2.74 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.667 0.746 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.8 Cg_endo -69.78 -50.68 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.661 2.241 . . . . 0.0 112.304 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.21 -64.84 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 149' ' ' ARG . . . -45.39 -31.02 3.21 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.467 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -76.51 -44.52 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 110.918 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -70.44 -42.41 71.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 15.8 mmt -65.07 -53.35 47.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.885 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' B' ' 145' ' ' GLY . 1.6 tmm_? -61.16 -42.34 98.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.839 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -66.43 -51.87 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.79 -32.05 71.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.671 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.17 -47.52 76.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.085 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 -45.32 91.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.855 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.33 -33.67 67.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.077 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -69.68 -50.19 46.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.671 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.8 p -65.14 -41.56 92.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . 0.428 ' N ' HG13 ' B' ' 156' ' ' VAL . 6.1 t70 -53.67 -52.06 61.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.45 75.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.436 ' O ' HD23 ' B' ' 163' ' ' LEU . 2.7 mp -56.92 -43.38 81.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.91 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -63.46 -44.37 94.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 25.1 m -56.25 -41.39 75.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.148 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -31.13 39.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.436 HD23 ' O ' ' B' ' 159' ' ' LEU . 1.8 mm? -70.13 -22.37 63.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.844 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.89 -62.86 3.53 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.579 0.704 . . . . 0.0 111.151 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.3 Cg_endo -69.76 -44.34 2.13 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.675 2.25 . . . . 0.0 112.337 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 18.1 m-30 -58.66 -29.91 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.9 67.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.83 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.48 -33.51 76.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -69.73 -51.89 30.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 20.5 tp -67.18 -49.34 65.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.921 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.96 -36.22 70.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.6 83.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -72.38 -40.75 67.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.18 -50.35 41.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.974 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.79 -40.73 80.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.21 -41.31 61.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.075 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -66.16 -34.01 77.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.864 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.56 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.2 tt -69.62 -49.72 51.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.933 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . 0.56 ' N ' HD23 ' B' ' 178' ' ' LEU . 77.0 mt-10 -69.27 -36.42 77.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.906 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -69.68 -49.14 56.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 2.2 tt -57.55 -41.81 81.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -71.73 -31.42 66.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.44 -55.27 33.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.862 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -63.55 -26.8 68.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.73 -34.58 44.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.462 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.52 -33.37 40.52 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.49 -24.47 42.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.75 0.309 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 5.0 mtt180 -73.02 -32.62 65.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -39.63 93.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.27 -49.22 36.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -49.5 75.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.04 -44.37 87.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.919 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -53.5 -49.39 67.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.39 -31.29 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -49.65 16.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.59 -34.68 78.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . 0.607 HG21 HD22 ' A' ' 240' ' ' LEU . 85.4 m -65.68 -47.56 75.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.113 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.49 -36.23 76.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -58.85 -46.39 87.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.01 -30.16 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 47.0 t -57.01 -51.02 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 41.1 p -68.61 -50.61 50.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 11.9 tp -54.37 -55.08 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 68.0 m -54.24 -36.06 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.86 -46.51 87.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 14.8 mttp -77.61 -30.02 52.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.76 64.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.1 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.513 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 2.1 mttt -61.01 -63.23 4.57 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.586 0.708 . . . . 0.0 110.865 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.1 Cg_endo -69.77 -26.8 27.15 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 0.0 112.31 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.61 -31.98 57.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.082 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.488 ' C ' HD13 ' B' ' 211' ' ' LEU . 2.7 tm? -72.02 -37.18 69.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -54.13 -50.85 65.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.865 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.32 -31.16 58.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.32 -50.97 70.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.9 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . 0.43 ' HD3' HD21 ' B' ' 211' ' ' LEU . 0.0 OUTLIER -68.4 -35.9 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.869 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.07 -48.91 77.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.492 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.96 -29.78 72.4 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.494 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.18 -32.63 74.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 0.0 110.908 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 0.9 OUTLIER -52.39 -61.7 4.21 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.612 0.72 . . . . 0.0 110.885 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.69 -43.96 2.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.719 2.279 . . . . 0.0 112.364 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 217' ' ' GLY . 57.1 t -57.24 -55.15 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.109 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.2 tt -59.72 -33.23 71.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.635 ' O ' HG23 ' B' ' 227' ' ' VAL . 5.0 mt-10 -68.49 -34.84 76.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 70.7 m -60.02 -47.85 84.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -65.84 -42.16 90.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -44.93 88.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.889 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.635 HG23 ' O ' ' B' ' 223' ' ' GLU . 42.9 t -55.46 -42.86 69.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.159 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.22 -49.96 75.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -64.69 -37.7 88.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.899 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.584 HD13 HD11 ' B' ' 233' ' ' LEU . 1.6 mm? -64.86 -34.5 78.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.943 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 19.4 m -72.1 -30.51 65.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . 0.419 ' HB1' ' CA ' ' B' ' 63' ' ' GLN . . . -67.96 -50.86 53.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.075 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.584 HD11 HD13 ' B' ' 230' ' ' LEU . 1.4 pp -67.41 -35.64 79.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.0 -39.61 69.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -72.81 -49.15 32.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.897 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -57.79 -41.45 82.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.908 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 81.3 m -65.77 -45.53 82.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -53.76 53.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 10.7 mtmm -57.82 -49.51 76.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.837 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.602 HD22 HG21 ' A' ' 197' ' ' THR . 0.5 OUTLIER -58.48 -35.02 71.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -70.24 -29.51 66.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.1 m 73.62 -68.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.125 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.882 -179.972 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.954 0.407 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.84 169.59 14.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.092 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -143.59 175.79 9.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -67.36 -41.18 85.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.483 ' O ' ' HB1' ' A' ' 232' ' ' ALA . 8.9 pttm -67.94 -40.79 83.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.912 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.505 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -71.74 -34.26 69.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -67.7 -50.94 55.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.884 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -66.63 -44.95 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.64 -22.6 66.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.978 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.59 HD12 HG11 ' A' ' 67' ' ' VAL . 0.2 OUTLIER -55.44 -32.38 62.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.896 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.413 ' C ' ' H ' ' A' ' 67' ' ' VAL . . . 116.41 -161.69 12.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.511 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 41.04 0.32 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.673 2.249 . . . . 0.0 112.344 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.59 HG11 HD12 ' A' ' 64' ' ' LEU . 22.6 m -77.09 -30.18 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.108 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 97.2 m -44.63 -35.96 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.143 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.49 -50.87 71.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -70.96 -27.65 63.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.89 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -63.87 -60.51 3.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.46 ' HB2' HD22 ' B' ' 189' ' ' LEU . 6.6 p-90 -64.94 -35.0 79.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.931 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.66 -53.77 25.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -66.68 -36.85 83.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.07 -55.25 27.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.53 -38.7 81.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.941 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.07 -50.94 69.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.21 -32.62 61.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.872 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.9 m -65.92 -23.92 66.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.47 -33.66 22.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.98 -30.73 54.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.487 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.678 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.9 tm? -51.73 -36.31 46.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.807 0.336 . . . . 0.0 110.932 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -49.79 75.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -41.3 96.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -48.34 81.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -40.05 96.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -50.6 73.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.78 -46.01 91.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.92 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.717 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.2 t70 -56.1 -47.59 77.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.23 -51.47 69.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -47.8 65.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.26 -38.41 91.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 89' ' ' ASP . 88.7 t -65.0 -31.75 55.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -74.96 -54.26 7.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.2 -30.16 70.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.156 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -79.0 -36.64 40.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.03 -45.0 83.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.122 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.552 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.3 mm-40 -43.84 -65.43 0.59 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.578 0.704 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.552 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 54.0 Cg_endo -69.76 -25.63 28.38 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.639 2.226 . . . . 0.0 112.367 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -53.56 -58.14 8.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 pp -54.92 -28.57 51.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.02 -47.62 73.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.844 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -44.19 87.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.863 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -50.52 72.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.89 -47.35 86.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -60.93 -26.24 67.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.927 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -45.27 62.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.895 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . 0.55 ' HE1' ' NH1' ' B' ' 149' ' ' ARG . 0.0 OUTLIER -69.96 -23.3 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -68.12 -64.48 0.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -62.94 -34.97 78.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.64 -30.32 66.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.924 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 45.3 ttp -65.99 -50.88 62.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -61.9 -41.31 97.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -24.79 55.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.958 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.767 ' O ' HG23 ' A' ' 119' ' ' VAL . 6.6 t80 -63.66 -55.05 26.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.922 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -69.95 -42.72 72.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.33 -26.61 67.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.876 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -89.63 -37.81 14.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.888 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.767 HG23 ' O ' ' A' ' 115' ' ' TYR . 50.8 t -58.47 -31.73 43.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.533 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -60.91 -64.78 2.71 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.67 0.748 . . . . 0.0 110.903 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.75 -51.03 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.677 2.251 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.9 -63.48 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.11 -30.72 1.9 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.524 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.32 -43.72 60.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.797 0.332 . . . . 0.0 110.859 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -74.95 -33.92 61.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -48.65 68.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.4 ' NH1' ' HE1' ' B' ' 108' ' ' TRP . 0.9 OUTLIER -69.21 -37.15 77.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -71.0 -50.82 30.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.7 -37.97 89.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.13 -43.51 98.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.092 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -62.18 -50.62 71.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.868 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.29 -30.29 69.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.118 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 35.7 t60 -68.36 -50.44 53.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.848 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 11.9 p -66.65 -37.26 79.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.161 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -57.2 -52.94 63.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.91 -49.15 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.549 ' O ' HD23 ' A' ' 163' ' ' LEU . 6.2 mt -56.43 -49.57 74.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.897 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.47 ' HB3' HD22 ' B' ' 101' ' ' LEU . 23.5 mmt-85 -60.17 -39.4 86.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 95.0 m -57.3 -48.04 79.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -76.14 -35.14 59.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.64 62.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.19 -62.43 5.98 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 0.0 111.133 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.8 -41.37 4.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.73 2.286 . . . . 0.0 112.323 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -61.57 -34.73 76.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.6 t -60.99 -45.76 93.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -62.56 -50.92 69.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.859 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.32 -51.43 69.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.551 ' C ' HD13 ' A' ' 170' ' ' LEU . 1.7 tm? -63.25 -46.57 86.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.954 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . 0.405 ' HG3' HD11 ' B' ' 90' ' ' LEU . 1.8 tpt85 -60.39 -38.09 82.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -34.65 78.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.14 -49.0 60.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.77 -50.92 30.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.945 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.2 -45.84 72.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.35 -36.03 71.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -32.35 72.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.415 ' O ' HD12 ' A' ' 178' ' ' LEU . 4.8 tp -72.26 -50.88 23.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.48 -45.0 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.69 93.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.124 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 55.4 tp -58.81 -40.87 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -66.26 -31.82 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -55.3 33.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -65.74 -26.23 67.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.19 -33.66 38.55 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.502 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.23 -32.7 37.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.507 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.36 -25.22 42.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.738 0.304 . . . . 0.0 111.078 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -72.91 -34.36 66.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.882 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.507 HD22 ' HB2' ' B' ' 72' ' ' TRP . 0.0 OUTLIER -62.5 -37.67 86.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -49.58 36.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.091 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.01 -48.77 77.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.892 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.27 -43.93 92.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' ' 197' ' ' THR . 85.1 t60 -53.27 -50.58 64.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.851 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.15 69.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -49.31 18.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.55 -36.72 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.081 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 193' ' ' HIS . 21.1 p -63.17 -47.58 82.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.148 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -35.96 80.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.55 -45.95 87.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.64 -30.24 65.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.943 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -50.9 71.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 54.3 m -68.18 -50.15 56.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.11 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.58 -54.05 46.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 67.0 m -54.59 -36.14 64.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.61 -47.78 83.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.905 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.2 -28.07 48.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.845 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.16 -22.08 63.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.152 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.494 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -60.22 -62.59 5.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.577 0.703 . . . . 0.0 110.908 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.494 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.81 -27.11 26.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.274 . . . . 0.0 112.354 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.82 -30.94 56.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.126 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -72.99 -37.52 66.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.879 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.06 -50.81 65.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.885 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.01 -30.71 61.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -51.35 70.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.888 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -37.18 81.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.73 -49.09 76.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.483 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.19 -29.42 73.3 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -62.98 -32.93 74.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 110.928 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.4 mp -52.17 -61.77 4.03 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.583 0.706 . . . . 0.0 110.935 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.72 -43.74 2.52 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.703 2.269 . . . . 0.0 112.338 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 217' ' ' GLY . 52.9 t -57.26 -53.69 40.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.182 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.63 -33.52 71.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 227' ' ' VAL . 1.8 tt0 -65.0 -36.0 82.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 47.7 t -61.84 -48.32 81.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.13 -41.06 82.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.919 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.76 -45.44 86.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.929 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 223' ' ' GLU . 28.9 t -56.8 -41.57 75.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.148 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.96 -50.12 75.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.05 -38.08 84.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.403 ' HA ' HD21 ' A' ' 233' ' ' LEU . 0.4 OUTLIER -62.09 -35.87 79.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.48 -30.53 67.36 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.824 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . 0.483 ' HB1' ' O ' ' A' ' 59' ' ' LYS . . . -66.84 -51.29 57.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.1 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 230' ' ' LEU . 0.8 OUTLIER -70.12 -41.05 74.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.29 -43.4 98.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.28 -47.57 76.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.85 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -53.99 -39.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.895 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 13.0 m -67.04 -44.8 79.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.11 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -55.5 33.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.31 -49.07 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 240' ' ' LEU . 0.4 OUTLIER -57.84 -39.81 78.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.859 179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -84.55 109.63 18.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 12.1 p -60.22 -74.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.913 0.387 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.03 169.64 14.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -143.66 176.26 9.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.894 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 m -67.88 -41.07 83.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.836 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.494 ' O ' ' HB1' ' B' ' 232' ' ' ALA . 8.9 pttm -68.02 -40.78 82.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.855 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.502 ' O ' HD23 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -71.73 -34.33 69.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -67.75 -50.91 54.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.906 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -66.58 -44.92 80.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.933 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.73 -22.6 66.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.586 HD12 HG11 ' B' ' 67' ' ' VAL . 0.2 OUTLIER -55.51 -32.22 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.921 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' B' ' 67' ' ' VAL . . . 116.24 -161.73 12.86 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.489 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 41.02 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.669 2.246 . . . . 0.0 112.36 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . 0.586 HG11 HD12 ' B' ' 64' ' ' LEU . 22.5 m -77.01 -30.13 17.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.147 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 97.0 m -44.72 -35.88 2.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.159 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.55 -50.79 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.954 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -71.02 -27.67 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.879 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -63.83 -60.48 3.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . 0.507 ' HB2' HD22 ' A' ' 189' ' ' LEU . 6.5 p-90 -65.01 -34.87 79.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -67.88 -53.67 24.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.889 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -66.67 -36.78 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.2 tp -63.14 -55.26 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.92 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -59.52 -38.71 81.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 20.9 tttt -56.04 -50.96 69.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.947 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -75.18 -32.69 61.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.885 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -65.77 -23.91 66.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.4 -33.63 21.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.95 -30.79 54.66 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.669 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.7 tm? -51.68 -36.42 46.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.8 0.333 . . . . 0.0 110.931 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -49.78 75.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.825 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -41.49 97.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -48.61 80.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -40.22 96.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -50.4 73.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -61.49 -46.73 88.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.721 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.1 t70 -55.85 -47.91 76.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.9 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.405 HD11 ' HG3' ' A' ' 171' ' ' ARG . 0.4 OUTLIER -57.8 -51.57 69.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.86 -47.96 64.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.45 -37.31 86.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 89' ' ' ASP . 88.6 t -65.7 -32.03 56.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.163 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -75.08 -55.49 5.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.945 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.98 -31.75 70.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.068 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt -78.78 -37.44 41.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.6 t -51.79 -51.6 26.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.576 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mm-40 -39.88 -67.27 0.29 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 110.895 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.576 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.8 Cg_endo -69.76 -20.65 34.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 0.0 112.37 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.48 -55.55 24.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.934 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 160' ' ' ARG . 1.4 pp -62.24 -28.39 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.969 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -49.23 78.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.07 -43.84 77.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.814 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.25 -50.81 71.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.844 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -59.7 -47.71 84.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -59.53 -25.41 64.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.39 -47.34 50.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.962 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . 0.4 ' HE1' ' NH1' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -66.56 -25.92 66.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 179.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -67.51 -65.58 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -60.97 -35.65 77.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.41 -29.9 66.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.886 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 39.3 ttp -65.63 -51.13 61.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.06 -41.27 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mp -75.83 -24.65 55.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.732 ' O ' HG23 ' B' ' 119' ' ' VAL . 8.4 t80 -63.74 -55.09 25.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -71.14 -39.55 71.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -25.67 68.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -91.8 -39.11 11.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.732 HG23 ' O ' ' B' ' 115' ' ' TYR . 45.0 t -58.85 -31.29 44.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.148 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.531 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -61.58 -64.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.662 0.744 . . . . 0.0 110.889 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.531 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.76 -50.61 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -63.82 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.63 -30.35 1.46 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.502 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -73.61 -45.0 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.815 0.34 . . . . 0.0 110.907 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -74.56 -35.78 63.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.37 47.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.905 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.55 ' NH1' ' HE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -65.57 -36.83 84.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.876 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -68.47 -50.72 50.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 2.8 ttp85 -64.14 -34.44 78.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.17 -50.38 70.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -56.67 -50.04 73.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.838 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.76 -30.97 70.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.11 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -68.75 -49.98 54.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.03 -36.76 78.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.142 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.71 -52.06 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.47 -49.51 68.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.122 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.556 ' O ' HD23 ' B' ' 163' ' ' LEU . 6.2 mt -56.8 -48.03 78.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.82 -40.12 91.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 92.5 m -57.47 -46.69 83.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.141 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -76.49 -35.73 58.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 159' ' ' LEU . 3.9 mm? -71.84 -15.76 62.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.78 -62.17 6.5 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.571 0.7 . . . . 0.0 111.108 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.6 Cg_endo -69.79 -42.24 3.54 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.663 2.242 . . . . 0.0 112.336 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -60.81 -33.55 73.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.4 t -61.49 -46.22 90.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.821 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -62.41 -48.9 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.96 -51.87 67.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 11.3 tp -61.2 -49.19 78.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -62.31 -34.56 76.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.7 -34.77 79.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -47.11 57.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.0 tp -70.17 -51.12 33.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.08 -45.12 75.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.3 -34.81 70.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.125 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -32.5 71.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.886 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.421 ' O ' HD12 ' B' ' 178' ' ' LEU . 4.9 tp -71.76 -50.22 31.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -67.35 -43.21 82.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.893 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.39 90.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.079 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 54.9 tp -60.03 -38.28 82.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -69.67 -32.22 70.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -55.13 35.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.885 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -65.62 -26.15 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.14 -33.75 38.36 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.481 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.12 -32.8 36.38 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.502 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.17 42.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.116 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -73.03 -34.29 66.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.836 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.46 HD22 ' HB2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -62.5 -37.71 87.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.02 -49.39 37.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.119 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -63.06 -48.7 77.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.42 -43.77 92.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.892 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 197' ' ' THR . 85.0 t60 -53.46 -50.42 65.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.851 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.03 -31.17 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.082 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.63 -49.24 19.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.79 83.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.091 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . 0.481 HG23 ' O ' ' B' ' 193' ' ' HIS . 21.2 p -63.12 -47.45 82.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.168 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -35.94 80.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.87 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -58.65 -45.89 88.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.844 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.62 -30.28 65.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -50.94 71.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.836 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 54.1 m -68.14 -50.07 57.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.164 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.64 -53.93 48.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.953 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 66.7 m -54.75 -36.07 64.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.868 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.67 -47.77 83.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 8.2 pttt -78.17 -28.03 48.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.9 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.33 -22.12 63.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.503 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -60.13 -62.66 5.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.524 0.678 . . . . 0.0 110.927 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.3 Cg_endo -69.81 -27.06 26.72 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.666 2.244 . . . . 0.0 112.338 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.92 -30.88 56.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.094 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.08 -37.41 66.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -53.89 -50.81 65.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -30.92 61.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.65 -51.57 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.898 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -37.57 82.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -56.68 -49.07 76.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.496 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.88 -29.51 73.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.49 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.03 -32.79 74.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.939 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.483 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 1.3 mp -52.18 -61.74 4.07 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.609 0.719 . . . . 0.0 110.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.483 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.7 Cg_endo -69.77 -43.69 2.5 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.671 2.247 . . . . 0.0 112.325 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 217' ' ' GLY . 54.6 t -57.27 -53.86 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.106 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.5 -33.55 71.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.566 ' O ' HG23 ' B' ' 227' ' ' VAL . 1.8 tt0 -64.93 -35.91 82.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.889 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 47.8 t -61.97 -48.3 80.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -68.13 -41.07 82.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.8 -45.49 86.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.887 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 223' ' ' GLU . 27.3 t -56.71 -41.65 75.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.105 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.02 -50.07 75.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.828 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -38.15 85.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' B' ' 233' ' ' LEU . 0.4 OUTLIER -62.07 -35.85 79.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.907 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 1.5 m -70.47 -30.53 67.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.858 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' B' ' 59' ' ' LYS . . . -66.83 -51.41 55.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.09 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' B' ' 230' ' ' LEU . 0.8 OUTLIER -69.94 -41.15 74.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.891 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.26 -43.55 97.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.866 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.22 -47.51 76.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -54.03 -39.2 65.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.92 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 12.9 m -66.96 -44.68 79.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.164 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -55.6 31.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.874 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -58.2 -49.08 78.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.551 HD13 ' O ' ' B' ' 240' ' ' LEU . 0.4 OUTLIER -57.83 -39.78 78.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.9 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -84.57 109.69 18.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 12.3 p -60.3 -74.34 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.118 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.901 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.92 0.391 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 11.7 t -98.87 154.67 17.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.149 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.38 159.06 42.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 m -72.22 -36.05 69.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.862 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -62.72 -43.0 99.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.911 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -34.35 77.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.904 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmt180 -69.05 -53.81 18.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.845 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.62 -35.63 81.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.547 ' CA ' ' HB1' ' A' ' 232' ' ' ALA . 0.4 OUTLIER -77.29 -24.83 50.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.892 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.569 HD22 ' HB ' ' A' ' 67' ' ' VAL . 0.7 OUTLIER -51.34 -44.17 61.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 91.61 -153.33 22.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -6.21 18.07 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.569 ' HB ' HD22 ' A' ' 64' ' ' LEU . 63.5 t -60.9 -30.19 46.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.133 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 9.1 t -45.87 -35.15 4.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.81 -48.65 80.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.912 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -69.54 -32.52 71.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -65.14 -52.39 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.91 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.413 ' CE3' HD22 ' B' ' 189' ' ' LEU . 0.0 OUTLIER -65.03 -35.92 82.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.903 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -64.77 -52.87 54.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -69.58 -35.36 75.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.783 ' O ' HG23 ' A' ' 79' ' ' THR . 9.3 tp -62.33 -55.4 28.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.26 -33.28 75.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -44.37 81.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.17 -37.48 63.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 75' ' ' LEU . 36.3 p -61.84 -21.04 64.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.099 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.09 -31.7 8.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.82 -29.85 43.01 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.466 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 82' ' ' LEU . 2.0 tm? -51.17 -35.25 35.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.845 0.355 . . . . 0.0 110.947 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -50.1 74.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.92 -40.87 95.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -47.41 85.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -40.79 98.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.86 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.409 ' HA ' HD12 ' A' ' 90' ' ' LEU . 2.9 m -58.32 -50.68 72.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.866 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -45.27 95.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.92 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.718 ' O ' HG23 ' A' ' 93' ' ' VAL . 1.0 OUTLIER -56.52 -48.01 78.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 87' ' ' SER . 8.8 mt -57.5 -51.61 68.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.15 -47.86 65.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -63.74 -36.8 85.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.852 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.718 HG23 ' O ' ' A' ' 89' ' ' ASP . 77.6 t -65.8 -32.11 56.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.087 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -74.94 -54.28 7.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.39 71.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.118 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.89 -35.94 42.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -57.56 -44.79 85.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.118 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.548 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 3.4 mt-30 -43.81 -65.18 0.62 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.584 0.707 . . . . 0.0 110.894 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.3 Cg_endo -69.71 -26.22 28.02 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.341 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -52.93 -58.48 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.93 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' B' ' 160' ' ' ARG . 1.3 pp -54.83 -27.84 45.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -43.81 85.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.87 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -71.97 -37.26 69.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.68 -53.23 58.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.894 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -42.86 98.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.5 tttt -62.56 -28.05 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.89 -45.79 60.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.944 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -24.01 64.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -66.75 -65.22 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.62 -35.47 77.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -71.1 -29.77 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -64.42 -51.29 63.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.883 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.48 -41.02 98.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.69 -24.12 56.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 119' ' ' VAL . 7.5 t80 -63.68 -55.76 20.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -63.44 -24.88 68.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.892 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -92.73 -32.99 14.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 115' ' ' TYR . 42.6 t -62.6 -32.07 54.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.158 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 9.4 tt0 -63.28 -61.7 6.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.3 Cg_endo -69.77 -51.21 0.4 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.702 2.268 . . . . 0.0 112.329 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.68 -62.93 1.37 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.937 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 119' ' ' VAL . . . -43.72 -30.72 1.61 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.474 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.79 -43.73 53.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.804 0.335 . . . . 0.0 110.855 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -37.4 64.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.921 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -48.99 67.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.9 tpp85 -67.77 -38.4 83.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.868 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -70.42 -50.87 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -38.06 89.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.839 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -62.53 -43.74 98.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.058 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -60.96 -51.25 70.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.857 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -68.02 -29.97 69.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.117 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -67.85 -51.07 52.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 152' ' ' ALA . 8.2 p -65.84 -39.47 84.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.141 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -54.61 -52.56 61.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.82 -48.3 74.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.108 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -42.57 78.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.514 ' HB3' HD13 ' B' ' 101' ' ' LEU . 1.5 mpt_? -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.832 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.8 -47.49 82.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.112 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -78.83 -35.51 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 5.8 tt -71.68 -15.4 62.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -61.25 -62.69 5.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 0.0 111.142 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.6 Cg_endo -69.76 -40.81 4.89 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . 0.48 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 14.4 t80 -61.92 -34.64 76.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.3 t -61.27 -46.19 91.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.874 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.54 -48.95 78.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.889 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.08 -52.01 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.48 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 12.4 tp -59.58 -50.14 75.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . 0.528 HH21 HG11 ' B' ' 93' ' ' VAL . 7.2 mmm180 -63.71 -34.38 77.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.9 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -35.38 79.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.928 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.19 -50.82 24.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.96 -51.72 56.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.916 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.91 -44.83 74.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.061 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.71 -35.09 70.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -65.84 -33.1 75.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 178' ' ' LEU . 1.4 tp -73.8 -51.06 17.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.74 -50.33 65.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.83 -47.74 79.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.119 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 59.1 tp -56.81 -40.03 75.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.9 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -65.94 -32.73 74.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -55.0 37.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.879 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -67.78 -26.13 65.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.9 -33.95 36.93 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.491 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.86 36.17 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.462 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.76 43.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.766 0.317 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -73.27 -35.89 66.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.485 HD22 ' CE3' ' B' ' 72' ' ' TRP . 0.3 OUTLIER -62.29 -37.44 85.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.882 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.96 -49.01 41.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.164 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -50.75 71.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.91 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.12 -42.22 85.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -53.95 -49.49 68.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.877 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.12 70.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -75.56 -49.91 17.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.11 -35.26 79.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . 0.93 HG23 HD13 ' B' ' 240' ' ' LEU . 59.3 m -64.21 -47.79 78.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.147 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -36.74 80.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.857 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -58.93 -43.8 91.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.34 -31.02 65.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -50.94 71.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 23.1 p -67.72 -50.41 57.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.113 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.59 -52.69 61.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 27.5 t -55.23 -35.84 65.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.848 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.87 -48.07 82.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -29.18 50.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.43 -21.55 63.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.111 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.497 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 1.8 mtpp -59.86 -62.54 5.69 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.615 0.722 . . . . 0.0 110.9 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.6 Cg_endo -69.71 -27.26 26.92 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 0.0 112.343 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.5 -31.85 57.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.121 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.495 ' C ' HD13 ' A' ' 211' ' ' LEU . 3.0 tm? -72.8 -37.46 67.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.85 -51.33 63.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.868 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.78 61.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.97 -50.8 70.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.945 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.23 -37.48 85.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.829 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -56.52 -48.31 77.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.926 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.538 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -68.81 -28.39 73.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.508 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 23.3 tp -66.07 -33.33 75.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.83 0.348 . . . . 0.0 110.931 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 1.9 tp -49.98 -60.13 5.69 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 0.0 110.911 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.1 Cg_endo -69.77 -39.56 6.34 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.692 2.261 . . . . 0.0 112.345 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.7 t -58.35 -54.49 32.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.02 -34.88 73.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.949 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 227' ' ' VAL . 10.2 tt0 -64.85 -35.17 80.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.882 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.03 -48.54 79.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.85 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -40.76 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.862 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.21 -47.7 78.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 223' ' ' GLU . 37.7 t -56.79 -40.17 69.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.153 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.64 -50.18 74.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -61.34 -38.65 87.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.885 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.774 HD13 HD11 ' A' ' 233' ' ' LEU . 0.2 OUTLIER -63.43 -35.28 79.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.896 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 8.8 m -69.9 -30.15 67.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . 0.547 ' HB1' ' CA ' ' A' ' 63' ' ' GLN . . . -68.9 -50.96 45.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.11 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.774 HD11 HD13 ' A' ' 230' ' ' LEU . 1.0 OUTLIER -69.25 -42.05 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.0 -38.82 92.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.66 -47.3 63.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . 0.699 ' CZ ' HD11 ' A' ' 240' ' ' LEU . 11.1 t80 -54.07 -39.23 66.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.892 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' O ' ' A' ' 233' ' ' LEU . 36.5 p -69.27 -45.63 69.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.149 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.41 -54.3 42.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.903 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.92 -36.3 81.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.877 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.939 HD13 HG23 ' B' ' 197' ' ' THR . 9.5 mt -57.57 -40.94 80.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 176.75 98.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 53.0 m -163.35 -43.62 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.113 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.926 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.966 0.412 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 11.8 t -97.72 153.51 18.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.133 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.44 160.66 43.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.7 m -73.8 -37.1 65.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.844 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -62.41 -42.3 99.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.926 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -34.45 77.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.902 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -69.32 -53.67 18.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.908 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.64 -35.8 81.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.619 ' CA ' ' HB1' ' B' ' 232' ' ' ALA . 0.4 OUTLIER -77.31 -24.49 50.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.93 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.574 HD22 ' HB ' ' B' ' 67' ' ' VAL . 0.7 OUTLIER -51.29 -43.88 61.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 91.1 -153.58 22.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.479 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -6.25 18.13 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.686 2.257 . . . . 0.0 112.33 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . 0.574 ' HB ' HD22 ' B' ' 64' ' ' LEU . 64.0 t -60.97 -30.11 46.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.11 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 9.0 t -45.96 -35.2 4.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -48.59 80.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -69.59 -32.53 71.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.854 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -65.15 -52.34 55.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.883 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . 0.485 ' CE3' HD22 ' A' ' 189' ' ' LEU . 0.0 OUTLIER -65.11 -35.93 82.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.859 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 11.9 t0 -64.74 -52.8 55.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -69.68 -35.38 75.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.891 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.777 ' O ' HG23 ' B' ' 79' ' ' THR . 9.3 tp -62.2 -55.42 28.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -33.29 75.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.887 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.6 -44.38 81.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.909 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.09 -37.94 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . 0.777 HG23 ' O ' ' B' ' 75' ' ' LEU . 36.8 p -61.33 -20.94 63.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.108 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -49.08 -31.8 8.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.74 -29.9 42.45 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.498 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.682 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.9 tm? -51.17 -35.33 35.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 110.945 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -50.12 74.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.79 -40.95 96.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.02 -47.73 84.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -40.56 98.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . 0.412 ' HA ' HD12 ' B' ' 90' ' ' LEU . 2.9 m -58.24 -50.52 73.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -45.47 93.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.882 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.41 -48.27 77.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.896 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' B' ' 87' ' ' SER . 8.0 mt -57.38 -51.6 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -51.86 -47.87 64.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -64.14 -36.08 82.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.3 t -66.44 -32.16 56.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 2.2 tmtt? -75.28 -55.27 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.879 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.73 70.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.135 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -78.85 -36.68 41.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.5 t -52.76 -50.59 41.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.573 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 3.4 mt-30 -40.77 -66.75 0.35 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.533 0.682 . . . . 0.0 110.926 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.573 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.9 Cg_endo -69.78 -21.72 33.0 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.675 2.25 . . . . 0.0 112.349 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -52.89 -56.14 18.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.875 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.514 HD13 ' HB3' ' A' ' 160' ' ' ARG . 1.2 pp -61.19 -28.19 68.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.907 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 -45.9 90.23 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.844 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -73.09 -38.0 66.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.09 -53.5 56.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.874 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -42.66 99.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.873 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -61.84 -26.99 68.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -72.79 -47.94 42.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -26.67 68.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.24 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -61.11 -35.52 77.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -71.22 -29.46 65.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -64.44 -50.67 66.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -64.19 -40.22 95.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.26 -24.76 57.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.739 ' O ' HG23 ' B' ' 119' ' ' VAL . 18.1 t80 -65.18 -55.66 17.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.916 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -39.47 83.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -66.2 -24.95 66.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -92.24 -37.79 12.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.923 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.739 HG23 ' O ' ' B' ' 115' ' ' TYR . 52.1 t -60.4 -31.86 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.125 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.516 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.4 mt-10 -61.85 -63.86 3.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 0.0 110.872 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.9 Cg_endo -69.73 -50.39 0.47 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.276 . . . . 0.0 112.363 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.93 -63.89 1.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.99 -30.16 1.67 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.5 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.31 -44.34 37.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.866 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -44.36 61.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.859 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -51.78 62.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -61.62 -42.04 98.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.68 -50.49 62.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -33.78 75.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.63 -50.75 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.074 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -55.98 -50.34 71.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.881 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.66 -30.87 70.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.109 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -67.92 -50.63 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.35 -39.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -54.66 -52.28 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.97 -48.27 74.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.062 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.76 -42.38 79.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . 0.468 ' HB3' HD13 ' A' ' 101' ' ' LEU . 7.7 mpt_? -66.41 -39.18 88.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 85.2 m -57.79 -47.29 82.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.155 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -79.03 -35.35 42.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.829 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 5.9 tt -71.76 -15.93 62.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.887 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.65 -62.66 5.52 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.605 0.717 . . . . 0.0 111.122 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.2 Cg_endo -69.75 -40.15 5.67 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 0.0 112.356 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . 0.413 ' CZ ' HD22 ' B' ' 170' ' ' LEU . 14.4 t80 -62.71 -34.32 76.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.892 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -61.35 -46.45 90.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.86 -48.16 81.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.44 -51.86 63.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.906 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' B' ' 166' ' ' TYR . 12.4 tp -60.08 -49.56 77.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . 0.414 HH21 HG11 ' A' ' 93' ' ' VAL . 7.2 mmm180 -63.89 -34.29 77.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.76 -35.73 80.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -72.03 -50.82 25.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -51.58 58.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.25 -44.31 75.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.113 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.82 -35.05 69.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -65.25 -33.86 77.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.431 ' O ' HD12 ' B' ' 178' ' ' LEU . 1.5 tp -73.52 -50.53 20.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.925 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.32 -47.55 76.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -60.04 -48.74 80.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 57.9 tp -57.3 -36.28 70.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -70.36 -33.7 71.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -54.16 47.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.846 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -67.95 -25.95 65.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -51.85 -33.87 36.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.516 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.03 -32.19 34.45 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.46 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.32 -25.51 42.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.327 . . . . 0.0 111.102 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 8.3 ttp180 -73.01 -36.81 67.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.897 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.413 HD22 ' CE3' ' A' ' 72' ' ' TRP . 0.3 OUTLIER -61.54 -37.26 83.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.935 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.91 -48.82 42.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.094 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -51.29 69.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -57.91 -42.48 84.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.874 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -53.52 -49.67 67.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.85 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.29 -31.05 70.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.135 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -75.51 -49.87 17.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.909 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.39 -35.44 79.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.118 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . 0.939 HG23 HD13 ' A' ' 240' ' ' LEU . 56.5 m -64.02 -47.72 79.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -36.76 80.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.892 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -58.97 -43.57 91.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 42.8 tp -72.51 -31.05 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -50.87 71.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.833 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 23.2 p -67.66 -50.41 57.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.15 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 26.7 tp -54.68 -52.65 61.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.882 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 27.7 t -55.25 -35.79 65.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.839 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -58.96 -48.04 82.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.87 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.79 -29.18 50.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.58 -21.41 63.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 1.8 mtpp -59.98 -62.53 5.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.555 0.693 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.5 Cg_endo -69.78 -27.24 26.61 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.686 2.257 . . . . 0.0 112.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.58 -31.87 57.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.487 ' C ' HD13 ' B' ' 211' ' ' LEU . 3.0 tm? -72.66 -37.5 67.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.94 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -53.88 -51.17 64.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.79 -30.77 61.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.81 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 4.4 tt -62.09 -50.85 70.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.864 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.2 ttp85 -66.15 -37.49 85.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.842 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -56.45 -48.37 77.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.563 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -68.76 -28.37 73.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.494 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 23.4 tp -66.12 -33.32 75.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.9 tp -50.07 -60.03 5.92 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.598 0.713 . . . . 0.0 110.918 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.9 Cg_endo -69.76 -39.63 6.28 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.662 2.241 . . . . 0.0 112.369 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.36 -54.51 31.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.161 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.01 -34.87 73.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.536 ' O ' HG23 ' B' ' 227' ' ' VAL . 10.2 tt0 -64.9 -35.11 80.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.863 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.6 t -62.09 -48.52 79.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.854 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.57 -40.87 76.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.927 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -64.16 -47.75 78.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.902 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.536 HG23 ' O ' ' B' ' 223' ' ' GLU . 37.7 t -56.74 -40.21 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.136 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.18 74.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -61.35 -38.6 87.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.785 HD13 HD11 ' B' ' 233' ' ' LEU . 0.2 OUTLIER -63.38 -35.45 80.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 8.6 m -69.78 -30.22 67.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . 0.619 ' HB1' ' CA ' ' B' ' 63' ' ' GLN . . . -68.95 -50.86 45.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.122 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.785 HD11 HD13 ' B' ' 230' ' ' LEU . 1.0 OUTLIER -69.28 -42.12 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -38.73 92.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.892 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.71 -47.26 63.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . 0.689 ' CZ ' HD11 ' B' ' 240' ' ' LEU . 11.3 t80 -54.17 -39.13 66.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . 0.717 HG23 ' O ' ' B' ' 233' ' ' LEU . 35.9 p -69.32 -45.63 69.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.135 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -54.47 -54.24 43.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -66.84 -36.35 82.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.931 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.93 HD13 HG23 ' A' ' 197' ' ' THR . 9.4 mt -57.52 -40.89 79.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 176.7 98.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.94 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 53.3 m -163.38 -42.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.133 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.989 0.423 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 15.3 p -134.0 89.29 2.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.138 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -167.06 -43.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -64.31 -37.26 86.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -70.78 -46.35 63.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.862 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.57 -35.91 79.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -67.95 -47.97 67.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.882 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.53 -33.98 71.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.902 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -75.28 -29.73 60.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.492 HD13 ' C ' ' A' ' 64' ' ' LEU . 3.1 tm? -53.38 -45.75 69.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 172.32 157.41 14.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.481 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -90.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 0.0 112.312 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -58.98 -33.22 49.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.129 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.4 m -59.32 -39.86 84.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -64.39 -51.83 61.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.99 -29.67 71.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -66.33 -67.15 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -57.99 -32.48 67.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -71.51 -48.32 49.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.919 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.63 -49.84 75.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.901 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.5 -57.04 10.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.12 -33.79 58.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.63 -52.85 55.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -27.83 65.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.0 m -58.61 -26.9 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -50.87 -47.44 60.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.93 -29.26 19.52 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.514 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 82' ' ' LEU . 1.1 tm? -49.83 -43.21 48.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 0.0 110.933 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.9 ttt180 -58.03 -49.42 76.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.79 88.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.897 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.26 -49.95 72.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.924 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -42.54 81.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.77 -50.5 73.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.838 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -43.56 89.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -57.16 -48.49 78.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.2 tp -57.01 -49.87 74.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.28 -48.0 71.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.43 -35.98 82.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 64.9 t -65.39 -32.83 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.092 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -74.5 -52.63 11.39 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.92 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.76 -32.58 72.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -77.98 -33.57 51.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.1 t -58.98 -43.29 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.537 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.4 OUTLIER -43.95 -64.93 0.67 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.59 0.709 . . . . 0.0 110.911 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.69 -30.31 22.81 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 0.0 112.371 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -58.25 -27.44 63.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.949 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -50.71 28.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -33.79 76.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.48 -48.12 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.838 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -56.59 -52.57 64.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -45.7 84.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -62.9 -22.71 66.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -72.95 -47.73 42.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -30.0 70.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -56.23 15.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.97 -34.39 71.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.887 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -69.51 -34.41 74.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.876 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 23.5 ttp -68.84 -54.29 16.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.881 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -64.29 -35.78 81.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 47.2 tp -76.67 -26.06 54.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.7 t80 -62.81 -55.35 27.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -35.14 62.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 tt0 -68.02 -23.95 65.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -85.82 -43.85 12.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 60.6 t -59.39 -32.47 48.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.55 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 2.3 mm-40 -56.54 -65.58 1.57 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.663 0.744 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.9 Cg_endo -69.74 -52.3 0.34 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.637 2.224 . . . . 0.0 112.357 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.24 -65.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.27 -33.95 2.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -76.22 -44.77 36.14 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.791 0.329 . . . . 0.0 110.88 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -66.86 -43.52 83.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -47.13 73.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -64.99 -42.34 94.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.84 -53.08 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.26 -38.53 83.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.862 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.75 -42.02 99.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -60.21 -53.26 59.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.01 50.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -56.95 -46.03 82.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 5.1 t -59.33 -52.5 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.172 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.36 -52.37 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.845 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.38 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.134 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.19 -44.26 87.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -67.54 -43.99 79.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 23.9 m -55.84 -42.1 75.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.171 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 -33.89 30.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.13 -23.19 62.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -55.49 -62.57 4.24 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.577 0.703 . . . . 0.0 111.043 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.0 Cg_endo -69.72 -43.13 2.87 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.709 2.273 . . . . 0.0 112.324 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -60.9 -28.99 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 12.7 t -59.67 -51.82 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.818 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.29 -48.93 68.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.65 -51.58 68.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.472 ' C ' HD13 ' A' ' 170' ' ' LEU . 2.3 tm? -61.06 -46.57 90.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.875 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -42.96 81.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.878 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -34.46 78.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -49.76 57.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -50.58 45.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . 0.494 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.94 -35.58 64.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.34 -34.32 55.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.118 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -48.28 81.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.6 pp -68.83 -49.18 60.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.513 ' N ' HD12 ' A' ' 178' ' ' LEU . 0.2 OUTLIER -58.76 -50.53 73.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.87 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.59 87.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.136 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 52.7 tp -67.75 -34.85 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -31.28 66.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.92 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -55.23 -55.73 27.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.893 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.96 -26.27 66.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.85 39.08 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.497 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . 0.43 ' HA2' HD23 ' A' ' 189' ' ' LEU . . . -52.08 -33.89 38.21 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.53 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.06 -23.83 38.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.763 0.316 . . . . 0.0 111.08 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -32.53 67.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.885 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.43 HD23 ' HA2' ' A' ' 186' ' ' GLY . 1.4 pp -63.14 -36.92 85.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.886 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.54 -49.53 32.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.13 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -44.89 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.856 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -60.4 -46.82 88.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.887 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -49.23 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.898 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.89 -31.69 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.46 -49.31 16.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.68 78.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.129 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 99.9 m -66.32 -47.61 72.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -69.9 -36.24 75.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.44 84.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.872 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 5.4 mp -71.23 -30.13 65.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 -51.33 69.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.836 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.66 -50.37 51.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.133 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.97 -54.92 32.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 43.2 m -54.62 -35.66 63.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.827 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.56 -48.35 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.09 -27.8 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.24 -22.01 64.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.501 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 9.9 mmtt -61.21 -63.07 4.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.567 0.699 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 54.6 Cg_endo -69.69 -26.92 27.43 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.717 2.278 . . . . 0.0 112.354 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.71 -32.88 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.52 -36.65 73.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.926 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -54.32 -50.62 66.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.48 -30.49 63.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.14 -48.41 78.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 219' ' ' LEU . 0.9 OUTLIER -70.39 -41.97 72.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.7 -25.76 68.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.955 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.558 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -79.04 -44.49 9.8 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.73 -27.54 68.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.501 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 2.7 mp -50.85 -62.97 2.18 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 0.0 110.892 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.501 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.0 Cg_endo -69.69 -44.63 2.01 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.755 2.304 . . . . 0.0 112.328 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 217' ' ' GLY . 90.5 t -55.88 -54.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.133 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.85 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.946 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 227' ' ' VAL . 4.5 mt-10 -66.37 -40.12 89.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -48.06 83.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.872 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.91 -38.06 82.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 223' ' ' GLU . 54.7 t -56.78 -49.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.145 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -50.75 72.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.832 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.38 -37.98 82.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.2 -40.59 97.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -31.28 72.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.884 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.91 -44.93 68.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.697 HD23 ' N ' ' A' ' 234' ' ' GLU . 0.0 OUTLIER -61.27 -38.99 88.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . 0.697 ' N ' HD23 ' A' ' 233' ' ' LEU . 0.7 OUTLIER -74.6 -35.4 62.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -68.05 -48.87 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -63.74 -41.01 98.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.97 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 233' ' ' LEU . 37.9 p -70.75 -45.88 63.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.078 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 23.0 mmtp -56.22 -55.07 37.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.83 79.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 30.8 mt -57.77 -37.72 74.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.43 -30.36 69.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.3 m 73.08 -68.45 0.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.146 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.904 179.98 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.956 0.407 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 15.4 p -134.11 89.43 2.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -167.27 -43.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.9 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 6.7 p -64.57 -37.23 86.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.862 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -70.79 -46.27 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.72 -35.67 79.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.1 -47.9 66.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.59 -34.1 71.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.868 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -75.06 -29.89 60.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.925 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.491 HD13 ' C ' ' B' ' 64' ' ' LEU . 3.1 tm? -53.34 -45.87 69.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 172.34 157.4 14.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.477 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -90.25 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.649 2.233 . . . . 0.0 112.359 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 27.4 m -58.82 -33.22 48.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.161 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 1.4 m -59.39 -39.75 84.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.171 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -64.53 -51.86 60.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.923 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -62.93 -29.75 71.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.934 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 63.4 t80 -66.23 -67.01 0.48 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.899 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -32.41 68.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.95 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -71.58 -48.49 47.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.817 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -57.47 -50.0 74.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -57.01 10.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -54.06 -33.73 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.885 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -64.75 -52.85 54.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -27.8 65.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -58.6 -26.84 64.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.148 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -51.02 -47.67 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -29.26 18.86 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.528 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.559 HD13 ' O ' ' B' ' 82' ' ' LEU . 1.1 tm? -49.95 -42.98 49.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -58.15 -49.47 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -44.77 88.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.908 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.21 -50.14 72.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.866 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.26 -42.28 81.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.856 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 1.1 t -58.88 -50.41 74.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -43.64 90.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.881 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.704 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.88 -48.87 77.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 39.1 tp -57.04 -49.49 75.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.955 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -54.31 -47.83 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.937 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -36.11 82.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.918 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 89' ' ' ASP . 69.6 t -65.41 -32.7 59.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.099 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -75.09 -52.96 9.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.14 73.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.101 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -78.26 -33.83 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.58 -47.53 78.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.139 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.558 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.4 OUTLIER -42.61 -66.23 0.45 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.619 0.723 . . . . 0.0 110.942 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.2 Cg_endo -69.77 -29.6 23.58 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.695 2.264 . . . . 0.0 112.303 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.435 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.5 t80 -58.0 -26.15 62.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.896 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.89 -49.43 17.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.932 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.15 -33.55 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.86 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -47.56 63.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -55.83 -52.94 62.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.887 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -47.28 79.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -60.37 -22.33 63.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.867 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -74.11 -48.47 29.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.871 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -31.92 73.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.932 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.6 -55.45 20.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.96 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -70.7 -34.57 72.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -69.79 -33.0 71.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 20.5 ttp -69.65 -54.4 14.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.64 -35.76 82.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -76.29 -25.98 55.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.738 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.7 t80 -62.92 -55.19 28.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -33.86 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.449 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 2.3 tt0 -69.37 -23.33 63.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -87.47 -44.99 10.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.891 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 115' ' ' TYR . 58.9 t -59.9 -32.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.122 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.545 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 2.2 mm-40 -57.16 -65.35 1.78 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.3 Cg_endo -69.86 -51.4 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.66 2.24 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -65.89 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.942 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -42.32 -34.17 1.53 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.504 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.1 tp10 -77.14 -47.01 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 110.877 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.32 -47.69 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -51.46 63.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -60.04 -44.13 94.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.854 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.21 -52.22 50.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.825 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -60.95 -33.33 73.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.429 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.36 -46.42 83.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 9.7 ttp180 -58.9 -52.71 64.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -58.51 -54.88 42.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -57.9 -42.6 85.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.6 t -61.08 -51.47 72.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.27 -50.87 28.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.85 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.32 -44.65 87.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.093 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 5.7 tp -57.93 -41.61 83.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 -67.89 -45.4 74.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.86 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 23.8 m -55.94 -41.23 74.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -81.54 -33.98 31.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.833 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 1.2 tt -70.67 -23.38 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.822 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -55.52 -62.42 4.51 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.546 0.689 . . . . 0.0 111.123 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.822 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.3 Cg_endo -69.77 -41.29 4.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.679 2.253 . . . . 0.0 112.38 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -62.56 -29.34 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 7.7 t -59.62 -51.47 69.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.79 -49.11 69.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.95 -51.57 68.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' B' ' 170' ' ' LEU . 2.4 tm? -60.98 -46.68 89.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -42.62 81.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -34.65 78.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -48.8 63.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.875 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -50.59 40.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.947 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -55.22 -35.23 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.091 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -77.33 -34.31 55.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.103 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -48.28 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.904 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.509 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.6 pp -68.99 -48.86 62.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.937 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . 0.509 ' N ' HD12 ' B' ' 178' ' ' LEU . 0.2 OUTLIER -58.72 -50.51 73.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.08 89.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 52.5 tp -67.68 -34.84 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -31.77 66.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -55.12 -55.59 29.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -66.77 -26.21 66.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.4 -33.67 40.19 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . 0.434 ' HA2' HD23 ' B' ' 189' ' ' LEU . . . -52.01 -34.08 38.03 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.465 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -81.04 -23.79 38.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.733 0.301 . . . . 0.0 111.097 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -32.52 67.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.434 HD23 ' HA2' ' B' ' 186' ' ' GLY . 1.4 pp -63.08 -37.01 85.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.51 -49.57 31.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.053 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -44.59 90.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -60.62 -46.96 88.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.43 -49.22 67.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.85 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.61 70.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.078 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -76.49 -49.24 17.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.4 -34.89 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 99.1 m -65.95 -47.64 73.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.173 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -69.94 -36.23 75.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.885 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -58.73 -47.37 84.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.33 -30.07 65.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.83 -51.24 69.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.856 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 5.0 m -68.75 -50.25 52.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.163 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.9 tt -54.17 -54.94 32.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.869 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 43.3 m -54.53 -35.71 63.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.57 -48.31 81.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 6.4 ptmt -78.07 -27.87 48.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -68.35 -21.97 64.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.075 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 9.8 mmtt -61.28 -63.13 4.67 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.597 0.713 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.8 Cg_endo -69.82 -26.7 27.01 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 0.0 112.358 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.03 57.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.34 -36.48 74.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -54.34 -50.31 67.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -30.54 63.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.17 -48.32 79.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.895 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . 0.47 ' O ' HD13 ' B' ' 219' ' ' LEU . 0.9 OUTLIER -70.42 -42.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -63.81 -25.59 68.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.937 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.54 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -79.03 -44.62 9.68 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.456 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.4 mt -64.64 -27.54 69.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.816 0.341 . . . . 0.0 110.93 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' B' ' 220' ' ' PRO . 2.6 mp -50.86 -62.92 2.23 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.593 0.711 . . . . 0.0 110.902 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.2 Cg_endo -69.81 -44.51 2.0 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.672 2.248 . . . . 0.0 112.323 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.54 HG23 ' O ' ' B' ' 217' ' ' GLY . 90.3 t -55.94 -54.19 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.132 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -32.88 71.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.915 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.746 ' O ' HG23 ' B' ' 227' ' ' VAL . 4.5 mt-10 -66.33 -40.08 89.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -48.05 83.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.847 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -40.19 93.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . 0.404 ' O ' HD23 ' B' ' 230' ' ' LEU . 0.5 OUTLIER -67.96 -38.07 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.904 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.746 HG23 ' O ' ' B' ' 223' ' ' GLU . 53.2 t -56.71 -49.09 79.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -50.75 72.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -60.42 -37.93 82.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.404 HD23 ' O ' ' B' ' 226' ' ' LYS . 1.6 mm? -63.24 -40.63 97.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.886 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.64 -31.26 72.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.865 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -69.92 -44.98 68.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.678 HD23 ' N ' ' B' ' 234' ' ' GLU . 0.0 OUTLIER -61.2 -39.04 88.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . 0.678 ' N ' HD23 ' B' ' 233' ' ' LEU . 0.7 OUTLIER -74.59 -35.51 62.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.827 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.96 -48.86 64.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.913 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -63.75 -41.09 98.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.923 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . 0.423 HG23 ' O ' ' B' ' 233' ' ' LEU . 38.0 p -70.69 -45.83 64.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.123 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -56.22 -55.06 37.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.33 -48.81 79.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.74 -37.75 74.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.943 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.58 -30.23 68.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.906 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.3 m 73.14 -68.62 0.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.161 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.921 0.391 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.15 -179.79 6.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.152 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.7 p90 -159.94 39.19 0.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.59 -37.14 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.837 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -69.92 -43.59 71.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.914 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.08 -39.65 95.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.952 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -49.48 60.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.855 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -65.09 -36.45 84.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.88 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -77.74 -25.52 49.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.48 HD13 ' C ' ' A' ' 64' ' ' LEU . 2.4 tm? -53.6 -43.52 68.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 126.35 79.26 0.31 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.484 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -47.12 1.0 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.696 2.264 . . . . 0.0 112.336 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.5 m -55.28 -38.01 46.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.2 m -71.83 -56.94 4.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.64 -34.96 69.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -70.01 -43.76 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.909 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -49.41 77.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.864 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -36.43 78.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.933 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -66.83 -52.45 43.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.828 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.6 -56.43 22.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.58 -34.45 74.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.929 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -56.48 -51.61 67.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.874 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -72.14 -32.12 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 82' ' ' LEU . 95.6 m -65.86 -23.69 66.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.135 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.409 ' O ' HD23 ' A' ' 82' ' ' LEU . 5.9 tt0 -50.04 -32.01 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.89 -27.85 14.84 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.592 HD23 ' H ' ' A' ' 83' ' ' ARG . 1.1 pt? -49.15 -34.71 14.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.79 0.329 . . . . 0.0 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.592 ' H ' HD23 ' A' ' 82' ' ' LEU . 3.4 ttm-85 -61.81 -49.88 74.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.12 -43.79 95.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.69 -49.69 74.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.903 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.18 -41.55 84.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.918 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -50.1 74.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.881 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.72 -44.29 90.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.874 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.716 ' O ' HG23 ' A' ' 93' ' ' VAL . 0.4 OUTLIER -56.24 -47.7 77.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.859 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 37.1 tp -57.39 -50.29 73.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.872 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -47.87 69.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.881 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -64.12 -34.86 79.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 89' ' ' ASP . 74.4 t -65.54 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.154 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -74.71 -52.88 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.833 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.72 -33.11 73.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.119 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -77.37 -33.25 55.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.48 -43.93 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.143 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.541 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.2 OUTLIER -43.87 -65.03 0.64 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.586 0.708 . . . . 0.0 110.897 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.541 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.75 -31.29 20.84 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.669 2.246 . . . . 0.0 112.375 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.409 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.6 t80 -58.18 -25.54 61.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.19 -50.17 35.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.95 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -64.36 -34.87 79.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.92 -47.98 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.91 -52.39 65.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -64.49 -43.89 92.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -64.38 -22.89 67.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -49.42 34.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . 0.401 ' CD1' ' HD2' ' B' ' 149' ' ' ARG . 0.5 OUTLIER -65.13 -29.06 69.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -56.86 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.878 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -70.99 -34.43 71.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.892 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.01 -34.3 75.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -68.89 -54.03 17.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.913 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.82 -35.58 81.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.866 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.62 -26.65 55.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -62.13 -55.24 30.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.945 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -34.01 61.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.86 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.444 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 48.2 tt0 -68.17 -23.83 64.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.895 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.2 mmtt -86.73 -44.33 11.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.918 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 115' ' ' TYR . 55.6 t -59.0 -32.65 48.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 1.1 mt-10 -56.91 -65.62 1.61 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.666 0.746 . . . . 0.0 110.896 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.1 Cg_endo -69.79 -52.19 0.34 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 0.0 112.302 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.66 -64.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.19 -32.39 2.51 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.514 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -44.85 34.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.868 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -68.06 -41.91 81.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -46.25 74.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.894 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.427 ' HG2' ' HG3' ' B' ' 112' ' ' MET . 13.5 tpp180 -66.49 -41.59 88.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.73 -52.86 18.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -59.54 -39.87 85.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.77 -41.15 99.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.139 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -52.63 64.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.906 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.21 45.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.123 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -56.29 -45.32 80.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.72 -52.17 64.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.088 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.03 -52.35 15.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.881 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.2 93.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.103 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.01 -44.23 87.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.3 -44.59 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 24.3 m -55.58 -42.11 74.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.125 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -81.86 -32.61 31.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.799 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -69.98 -24.51 63.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.929 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.842 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -54.38 -62.94 3.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 111.074 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.842 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.4 Cg_endo -69.78 -43.36 2.69 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.692 2.261 . . . . 0.0 112.348 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . 0.674 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.9 t80 -58.4 -33.4 69.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.876 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.7 -52.11 64.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -67.06 -31.95 72.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.881 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -66.79 -51.15 59.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.674 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -58.46 -49.76 76.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -36.31 72.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.853 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.82 -52.63 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.901 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.53 -47.74 77.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.84 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.1 -51.43 69.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 178' ' ' LEU . . . -54.61 -35.79 63.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.083 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.27 50.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.066 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -48.32 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.868 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' A' ' 179' ' ' GLU . 1.7 pp -67.42 -49.71 62.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' A' ' 178' ' ' LEU . 2.2 pp20? -59.71 -34.09 72.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.27 -45.3 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.081 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.57 -40.97 76.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.928 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -75.61 -32.2 60.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.929 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -56.82 15.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.844 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.75 -26.33 60.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.905 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.29 -34.39 40.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.53 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.21 -33.67 38.77 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.464 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.1 39.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.78 0.324 . . . . 0.0 111.08 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -73.56 -32.49 64.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.872 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.7 -37.91 89.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.2 -49.92 31.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.087 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -63.87 -42.1 97.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.1 -45.27 92.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -54.47 -47.9 72.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.829 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.65 72.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -76.04 -50.6 14.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.34 93.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.119 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . 0.547 HG21 HD13 ' B' ' 240' ' ' LEU . 83.6 m -61.43 -47.48 85.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.163 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -36.51 83.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.853 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.57 -44.66 89.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.842 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -71.85 -30.09 65.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 8.6 m -57.44 -51.37 69.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -51.06 50.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.197 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.33 -54.84 34.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.952 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 50.7 m -54.53 -35.23 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.09 -47.8 83.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -77.71 -30.28 51.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . 0.479 ' O ' HD23 ' A' ' 211' ' ' LEU . . . -68.22 -22.13 64.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.126 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.514 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.6 OUTLIER -59.14 -63.37 4.26 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 110.904 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.514 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.75 -24.73 29.4 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.722 2.282 . . . . 0.0 112.348 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.2 -32.5 59.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.092 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.506 HD13 HD22 ' A' ' 214' ' ' LEU . 1.9 mm? -73.12 -35.88 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -53.85 -51.6 63.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.15 -30.85 58.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.506 HD22 HD13 ' A' ' 211' ' ' LEU . 2.9 tt -61.89 -51.26 68.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.949 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.48 -37.13 84.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -56.74 -48.87 76.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.877 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.53 -29.53 74.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.478 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.24 -32.96 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.348 . . . . 0.0 110.921 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 220' ' ' PRO . 1.0 OUTLIER -49.81 -61.14 3.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.644 0.735 . . . . 0.0 110.912 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.1 Cg_endo -69.76 -39.61 6.31 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.663 2.242 . . . . 0.0 112.363 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.8 t -58.0 -54.73 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.21 74.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.679 ' O ' HG23 ' A' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.34 80.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.857 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 14.1 m -59.88 -48.19 82.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.825 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -43.1 94.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.863 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 223' ' ' GLU . 51.6 t -55.76 -43.56 74.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.2 -50.45 73.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.868 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -61.09 -38.98 88.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.848 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.793 HD22 HD11 ' A' ' 233' ' ' LEU . 3.0 tm? -62.19 -33.39 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -31.43 67.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.795 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.44 -53.05 39.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.119 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 230' ' ' LEU . 0.8 OUTLIER -66.18 -43.3 87.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.941 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.3 -34.65 78.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.55 -49.34 75.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.885 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.23 -45.83 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.907 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.36 -45.95 88.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.15 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.11 -53.89 50.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.928 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -45.88 77.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.502 HD13 HG21 ' B' ' 197' ' ' THR . 13.1 tp -56.91 -37.42 71.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 73.29 -68.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.842 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 76.19 -55.62 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.939 0.399 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.43 -179.54 6.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -159.98 39.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.0 -37.3 86.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.878 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm -69.88 -43.5 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.23 -39.54 94.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -49.51 59.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.05 -36.39 84.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -77.87 -25.39 48.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.497 HD13 ' C ' ' B' ' 64' ' ' LEU . 2.4 tm? -53.74 -43.47 69.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 126.42 79.16 0.31 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.502 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -47.23 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.666 2.244 . . . . 0.0 112.346 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -55.11 -37.94 44.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.129 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 22.0 m -71.86 -57.2 4.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.129 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.909 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -70.1 -43.96 70.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -49.32 78.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.873 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -36.43 78.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.66 -52.19 47.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.835 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -61.02 -46.51 90.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 tp -59.45 -56.4 22.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -60.8 -34.31 74.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -56.41 -51.54 67.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -72.23 -32.33 66.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . 0.473 ' O ' HD22 ' B' ' 82' ' ' LEU . 95.5 m -65.58 -23.54 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.153 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -50.22 -32.14 15.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.81 -27.98 14.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.435 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.594 HD23 ' H ' ' B' ' 83' ' ' ARG . 1.1 pt? -49.09 -34.61 14.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.314 . . . . 0.0 110.892 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . 0.594 ' H ' HD23 ' B' ' 82' ' ' LEU . 3.5 ttm-85 -61.85 -49.96 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.854 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -60.16 -43.75 95.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.898 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -56.67 -49.62 74.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -58.41 -41.34 84.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.895 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -50.15 74.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 11.0 mtmm -58.75 -44.37 90.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.714 ' O ' HG23 ' B' ' 93' ' ' VAL . 0.4 OUTLIER -56.1 -47.91 77.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.849 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.54 -49.88 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.924 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.46 -47.58 69.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -64.52 -34.93 79.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 89' ' ' ASP . 71.0 t -65.52 -32.9 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.129 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -75.36 -53.3 8.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.78 74.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.117 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -77.45 -33.43 54.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.3 t -55.31 -47.75 77.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.14 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.565 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -42.28 -66.49 0.41 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.609 0.719 . . . . 0.0 110.91 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.565 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.74 -30.45 22.37 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 13.8 t80 -57.5 -25.04 59.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.907 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.42 -49.4 19.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -59.68 -34.7 73.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.874 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -47.49 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -55.99 -52.57 63.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.46 -44.62 90.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mmtp -62.71 -22.5 66.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -50.28 22.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.906 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -63.42 -30.58 71.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.909 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -56.44 13.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.921 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.42 -34.88 73.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -69.14 -32.52 71.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.913 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . 0.427 ' HG3' ' HG2' ' A' ' 149' ' ' ARG . 2.7 tmm? -69.8 -54.01 15.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.893 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -65.6 -35.43 80.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.18 -26.63 56.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.74 ' O ' HG23 ' B' ' 119' ' ' VAL . 4.4 t80 -62.51 -55.07 30.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.957 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -33.36 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.448 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 48.8 tt0 -69.12 -22.78 63.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -88.39 -46.39 9.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.74 HG23 ' O ' ' B' ' 115' ' ' TYR . 56.4 t -58.72 -32.59 46.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.135 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.548 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 1.0 OUTLIER -57.5 -65.53 1.74 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.616 0.722 . . . . 0.0 110.871 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.548 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.6 Cg_endo -69.69 -51.66 0.38 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.685 2.257 . . . . 0.0 112.338 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -65.37 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -43.78 -32.0 2.03 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.503 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.27 -46.79 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.43 -46.34 73.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -51.96 61.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.401 ' HD2' ' CD1' ' A' ' 108' ' ' TRP . 12.9 tpp180 -60.32 -43.14 96.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.883 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.49 -52.01 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -59.97 -34.07 72.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.884 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.406 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -64.51 -45.27 87.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.115 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.852 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -60.25 -54.94 39.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.075 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -56.76 -43.87 81.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.862 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.406 HG23 ' O ' ' B' ' 152' ' ' ALA . 4.8 t -60.21 -51.34 74.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.117 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -47.48 -51.49 20.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.8 90.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.115 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 9.0 mt -58.08 -42.24 85.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.912 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -67.55 -45.63 75.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 24.2 m -55.61 -41.52 73.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.145 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -81.51 -32.89 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 17.6 mt -70.25 -24.6 63.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.916 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.833 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -54.23 -62.75 3.46 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.605 0.717 . . . . 0.0 111.089 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.833 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.7 Cg_endo -69.75 -42.37 3.47 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 0.0 112.346 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . 0.66 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.3 t80 -59.57 -33.68 71.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.43 -52.0 65.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -66.76 -32.34 73.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.8 -51.0 60.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.66 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.49 -49.57 76.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -36.13 72.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -52.43 62.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.891 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -64.16 -47.72 78.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.861 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 2.2 tp -60.41 -51.22 70.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.903 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . 0.527 ' HA ' HD21 ' B' ' 178' ' ' LEU . . . -54.82 -35.45 63.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.12 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -78.11 -32.34 50.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -47.94 60.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.561 HD12 ' N ' ' B' ' 179' ' ' GLU . 1.8 pp -67.85 -49.55 61.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . 0.561 ' N ' HD12 ' B' ' 178' ' ' LEU . 2.1 pp20? -59.57 -34.21 72.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -74.31 -45.39 47.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.068 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 1.3 mt -56.84 -40.93 76.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -75.64 -32.85 60.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.899 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -56.53 18.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.916 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -73.67 -26.31 60.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.855 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.45 -34.22 41.67 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.457 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.13 -33.71 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.529 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -80.21 -25.11 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.789 0.328 . . . . 0.0 111.129 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -73.54 -32.74 64.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -38.15 90.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.15 -49.71 33.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.124 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.97 -41.83 97.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.29 -45.46 91.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.33 -47.75 72.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.881 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.35 -31.55 72.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.084 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -76.03 -50.52 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.858 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.63 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.126 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . 0.502 HG21 HD13 ' A' ' 240' ' ' LEU . 80.9 m -61.27 -47.47 85.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.166 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -36.51 83.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -58.6 -44.55 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.819 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.01 -30.13 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.952 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 9.2 m -57.45 -51.24 70.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.835 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -51.02 50.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.137 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.44 -54.84 35.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.875 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 50.3 m -54.69 -35.09 63.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.1 -47.77 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -77.81 -30.4 51.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.883 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . 0.483 ' O ' HD23 ' B' ' 211' ' ' LEU . . . -68.19 -22.1 64.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.127 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.519 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.6 OUTLIER -59.15 -63.48 4.12 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.556 0.693 . . . . 0.0 110.911 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 53.9 Cg_endo -69.81 -24.71 29.12 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.718 2.279 . . . . 0.0 112.332 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.29 -32.29 58.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.112 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.498 HD13 HD22 ' B' ' 214' ' ' LEU . 1.8 mm? -73.19 -35.78 66.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -53.78 -51.45 63.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.914 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -76.16 -30.78 58.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.498 HD22 HD13 ' B' ' 211' ' ' LEU . 2.9 tt -61.95 -51.36 68.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -66.35 -37.12 84.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -56.76 -48.8 77.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.554 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.55 -29.41 73.98 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.5 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 59.3 tp -65.27 -32.98 74.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.897 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 1.0 OUTLIER -49.79 -61.13 3.91 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.62 0.724 . . . . 0.0 110.931 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.73 -39.71 6.24 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.707 2.271 . . . . 0.0 112.349 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 217' ' ' GLY . 48.6 t -58.06 -54.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.113 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 3.7 tt -59.73 -35.17 74.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.681 ' O ' HG23 ' B' ' 227' ' ' VAL . 2.7 tp10 -65.85 -35.37 80.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 14.0 m -59.86 -48.18 82.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -64.3 -41.94 96.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -43.15 94.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 223' ' ' GLU . 51.4 t -55.68 -43.49 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.152 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.2 t -59.34 -50.33 74.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -61.13 -39.01 88.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.854 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.755 HD22 HD11 ' B' ' 233' ' ' LEU . 3.0 tm? -62.18 -33.4 74.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.884 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.57 -31.34 66.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.06 39.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.143 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.755 HD11 HD22 ' B' ' 230' ' ' LEU . 0.8 OUTLIER -66.13 -43.23 87.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.917 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.34 -34.62 78.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.891 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.65 -49.25 75.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -58.18 -45.96 86.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.953 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 23.5 m -63.27 -45.97 88.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.119 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -55.17 -53.84 50.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -45.91 77.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.547 HD13 HG21 ' A' ' 197' ' ' THR . 13.1 tp -56.77 -37.52 71.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.922 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 73.25 -68.67 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 76.16 -55.58 0.59 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.135 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.1 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.966 0.412 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.28 148.18 4.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.145 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -142.87 38.71 1.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.869 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -75.02 -43.47 53.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.905 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -34.98 70.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.2 mp -69.94 -43.34 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -71.7 -34.5 69.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.31 -49.96 15.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -64.68 -22.86 67.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.593 HD21 ' HG2' ' A' ' 70' ' ' GLU . 0.2 OUTLIER -49.99 -18.28 0.51 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.919 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.561 ' C ' ' O ' ' A' ' 64' ' ' LEU . . . -21.99 -86.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.513 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 172.91 11.75 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.759 2.306 . . . . 0.0 112.342 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.537 HG23 ' N ' ' A' ' 68' ' ' THR . 21.1 m -75.8 -49.72 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.537 ' N ' HG23 ' A' ' 67' ' ' VAL . 11.9 m -51.2 -27.82 9.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.181 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.41 -45.76 65.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.959 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.593 ' HG2' HD21 ' A' ' 64' ' ' LEU . 11.9 tm-20 -62.5 -42.33 99.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -63.72 -59.86 4.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.897 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -27.53 65.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.5 -52.79 35.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.87 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.19 -34.94 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.88 -45.51 64.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.929 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.55 65.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.58 -32.04 65.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.14 -48.53 78.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.37 -45.48 31.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.124 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.57 -30.84 67.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.931 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.42 56.09 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.452 HD11 HD21 ' B' ' 178' ' ' LEU . 8.7 mt -58.89 -35.8 73.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -49.62 77.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.91 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -68.6 -48.21 64.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.12 -29.19 69.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.855 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.56 -51.81 13.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.0 p -65.66 -35.88 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -40.63 64.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -61.96 -48.09 81.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.67 -50.94 55.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -58.01 -42.47 85.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.89 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.45 -47.94 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.898 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 97' ' ' VAL . 4.4 t -56.72 -33.16 39.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.114 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -52.32 10.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.87 -35.61 77.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -79.27 -34.92 42.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.429 ' HA ' ' HB2' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -53.51 -44.77 57.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.112 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.56 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -47.67 -65.96 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.58 0.705 . . . . 0.0 110.92 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.56 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.6 Cg_endo -69.71 -24.87 29.42 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.668 2.245 . . . . 0.0 112.347 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.429 ' HB2' ' HA ' ' A' ' 97' ' ' VAL . 2.7 m-30 -61.35 -35.08 76.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.59 -51.66 16.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.943 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.05 -34.27 77.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.853 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -65.62 -47.32 76.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.41 -52.05 67.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -64.73 -47.52 77.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -63.99 -22.68 67.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.908 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -71.11 -48.52 51.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -23.31 57.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -64.99 -60.02 3.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.66 -34.32 73.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.42 -30.51 69.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.917 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -71.8 -53.28 13.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.87 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.29 -35.02 79.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.605 HD13 ' O ' ' A' ' 114' ' ' LEU . 3.1 tm? -76.35 -26.19 55.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.71 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.2 t80 -65.65 -54.76 23.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.951 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -72.87 -33.9 66.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.417 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 22.1 tt0 -70.19 -23.09 62.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.893 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -90.3 -45.22 9.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 115' ' ' TYR . 94.5 t -59.98 -32.45 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.139 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.539 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.0 OUTLIER -57.88 -64.68 2.45 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.637 0.732 . . . . 0.0 110.901 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.4 Cg_endo -69.8 -50.94 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.679 2.253 . . . . 0.0 112.32 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -63.54 1.04 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.5 -30.47 4.49 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.496 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.52 -43.32 56.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.328 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.19 -33.96 63.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 2.6 ttt -66.99 -48.94 66.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -38.26 86.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.872 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -71.57 -52.58 17.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.8 mmt-85 -63.0 -38.2 90.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.28 -37.69 88.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -64.04 -49.89 70.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.853 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.6 -38.67 70.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.043 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -66.9 -50.74 61.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 152' ' ' ALA . 4.8 p -64.32 -40.62 89.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.418 ' N ' ' CG1' ' A' ' 156' ' ' VAL . 22.4 t0 -52.61 -50.56 62.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.833 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.48 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.099 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.96 -38.73 73.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 18.5 tpp85 -68.51 -45.57 71.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.839 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 34.7 m -55.4 -40.98 72.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.77 -34.04 30.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.02 -21.47 62.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -56.44 -62.66 4.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.61 0.719 . . . . 0.0 111.098 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.9 Cg_endo -69.74 -42.23 3.61 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.335 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . 0.412 ' CZ ' HD23 ' A' ' 170' ' ' LEU . 11.5 t80 -55.76 -33.68 64.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -51.58 69.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.834 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.73 -32.69 73.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.864 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -50.05 72.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.412 HD23 ' CZ ' ' A' ' 166' ' ' TYR . 0.2 OUTLIER -59.21 -49.59 77.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.69 -37.74 76.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.62 -51.79 68.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.44 -38.69 81.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.831 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -41.92 75.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -45.45 75.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.085 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.25 -34.57 70.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.078 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.86 -37.5 87.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.603 HD23 ' N ' ' A' ' 179' ' ' GLU . 1.3 tt -68.09 -51.6 44.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.89 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.603 ' N ' HD23 ' A' ' 178' ' ' LEU . 10.2 pt-20 -65.93 -40.64 91.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.77 -46.48 77.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.069 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -35.88 79.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.898 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -31.84 69.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.888 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -56.15 21.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.865 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.8 -25.76 63.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.53 -31.72 44.67 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.511 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -64.02 -49.88 64.35 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.46 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.68 -21.83 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.322 . . . . 0.0 111.127 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -71.76 -29.11 64.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -49.91 75.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.914 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.45 -48.95 68.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.115 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -63.37 -51.45 65.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.903 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -54.11 -48.93 70.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.91 69.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.68 -42.4 41.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.922 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -65.94 -47.7 73.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.137 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 40.0 p -60.07 -46.82 88.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.187 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.88 -35.86 75.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.12 -54.27 46.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -28.7 64.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.53 -51.41 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.817 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -50.85 30.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.71 -57.34 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -54.46 -35.96 63.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.99 -47.84 81.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -27.75 44.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.31 66.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.524 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.0 OUTLIER -64.61 -63.99 3.17 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.581 0.705 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.524 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.4 Cg_endo -69.77 -26.85 27.13 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.724 2.283 . . . . 0.0 112.298 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.73 -31.75 59.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 5.7 tt -71.2 -40.83 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.65 -51.16 66.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -75.99 -29.81 58.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.851 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -45.78 91.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . 0.652 ' O ' HD13 ' A' ' 219' ' ' LEU . 8.4 mtp180 -72.92 -40.03 65.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -68.06 -25.12 65.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -80.7 -49.84 5.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.497 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -27.99 69.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.846 0.355 . . . . 0.0 110.925 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.652 HD13 ' O ' ' A' ' 215' ' ' ARG . 1.4 mp -50.51 -63.43 1.85 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.596 0.712 . . . . 0.0 110.948 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 219' ' ' LEU . 54.2 Cg_endo -69.74 -46.44 1.23 Allowed 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.709 2.272 . . . . 0.0 112.363 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 217' ' ' GLY . 94.0 t -54.59 -55.09 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.187 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.06 -31.71 70.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.937 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 227' ' ' VAL . 22.1 tt0 -69.11 -36.28 77.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.58 83.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.22 -44.22 97.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -40.25 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.879 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 223' ' ' GLU . 38.9 t -55.38 -48.39 76.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.102 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 2.3 t -59.02 -50.11 75.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.831 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.09 -35.22 79.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.859 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 230' ' ' LEU . 0.3 OUTLIER -64.09 -34.24 77.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.908 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 67.4 m -73.56 -31.4 63.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.55 57.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.113 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.514 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.7 pp -64.9 -37.93 89.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.5 -34.97 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.36 -49.9 57.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -58.93 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.905 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . . . . . . . . . 35.1 m -67.88 -39.81 83.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.145 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.63 -54.17 49.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -48.99 77.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.945 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.06 -33.47 69.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.96 -22.07 31.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.63 -68.79 0.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.92 179.971 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.924 0.392 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.45 148.12 4.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.11 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -142.8 38.87 1.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.88 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -75.11 -43.49 52.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.894 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.58 -34.94 70.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.885 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 8.2 mp -69.86 -43.46 71.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.937 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -71.67 -34.44 69.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.889 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -76.35 -49.99 15.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.86 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -64.71 -22.97 67.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.572 HD21 ' HG2' ' B' ' 70' ' ' GLU . 0.2 OUTLIER -49.93 -18.32 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.898 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . 0.568 ' C ' ' O ' ' B' ' 64' ' ' LEU . . . -21.87 -86.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.487 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 172.96 11.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.691 2.261 . . . . 0.0 112.34 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . 0.543 HG23 ' N ' ' B' ' 68' ' ' THR . 21.3 m -75.78 -49.66 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.11 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . 0.543 ' N ' HG23 ' B' ' 67' ' ' VAL . 11.9 m -51.3 -27.82 10.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.13 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -45.75 65.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.572 ' HG2' HD21 ' B' ' 64' ' ' LEU . 11.9 tm-20 -62.55 -42.24 99.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.8 -59.78 4.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -27.47 65.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.899 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.44 -52.84 34.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.857 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.16 -34.85 78.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.02 -45.42 63.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.0 -33.58 65.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -72.48 -32.13 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.1 -48.56 78.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.41 -45.49 31.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.118 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -58.55 -30.98 67.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.878 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -74.38 -33.49 56.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.441 HD11 HD21 ' A' ' 178' ' ' LEU . 8.6 mt -58.85 -35.78 73.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.794 0.331 . . . . 0.0 110.9 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -49.73 76.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -68.49 -48.0 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.892 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.34 -29.1 69.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 3.1 ttt -74.53 -51.6 14.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.912 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 19.1 p -65.93 -35.9 81.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.862 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.03 -40.61 64.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.41 ' O ' HG23 ' B' ' 93' ' ' VAL . 12.2 m-20 -62.15 -48.58 79.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -67.3 -50.75 59.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.93 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -57.78 -42.79 84.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.88 -45.05 60.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.896 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.495 ' O ' HG23 ' B' ' 97' ' ' VAL . 4.0 t -59.59 -33.93 53.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.134 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -53.91 7.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.87 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.124 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.8 tptt -79.14 -35.89 41.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.898 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 93' ' ' VAL . 0.9 OUTLIER -50.69 -47.64 28.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.113 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.595 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.3 OUTLIER -45.73 -68.07 0.33 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.576 0.703 . . . . 0.0 110.941 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.4 Cg_endo -69.74 -18.11 37.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.696 2.264 . . . . 0.0 112.35 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -66.18 -34.36 77.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.96 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -50.81 11.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.866 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.49 -35.52 74.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.93 -46.84 73.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -52.24 66.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.44 -47.93 74.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -62.52 -22.51 66.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -72.31 -48.42 42.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -24.98 59.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.888 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.17 -60.8 2.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -67.47 -34.59 77.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -69.19 -30.43 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.885 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -70.37 -53.67 15.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -66.68 -35.03 79.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.586 HD13 ' O ' ' B' ' 114' ' ' LEU . 3.1 tm? -76.06 -26.21 56.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.888 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.704 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.3 t80 -65.56 -54.94 20.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -73.12 -33.56 65.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.427 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 22.6 tt0 -70.45 -22.56 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.927 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -91.13 -45.61 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.92 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 115' ' ' TYR . 91.8 t -60.26 -32.77 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.155 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.0 OUTLIER -58.04 -64.54 2.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.644 0.735 . . . . 0.0 110.892 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.1 Cg_endo -69.76 -50.29 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.685 2.257 . . . . 0.0 112.319 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.35 -64.09 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.876 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.43 3.74 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.493 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -75.37 -45.39 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.822 0.344 . . . . 0.0 110.927 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.72 -35.93 62.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 1.8 ttt -66.66 -54.04 27.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.877 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -39.3 93.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -68.83 -52.68 27.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 7.4 mmt-85 -63.63 -32.26 73.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.482 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -65.31 -42.89 92.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.082 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -62.18 -46.54 88.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.22 69.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.08 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -66.76 -50.67 61.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.878 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.482 HG12 ' O ' ' B' ' 152' ' ' ALA . 9.8 p -63.49 -40.02 87.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.168 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . 0.415 ' N ' HG13 ' B' ' 156' ' ' VAL . 21.0 t0 -52.84 -50.32 63.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -66.73 -48.96 67.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.145 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.39 -38.07 73.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 20.7 tpp85 -68.61 -45.15 72.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.842 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 34.8 m -55.8 -40.83 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -81.94 -34.07 29.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.836 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.33 -21.63 62.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.81 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -56.15 -62.39 4.85 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 0.0 111.092 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.81 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 54.1 Cg_endo -69.71 -41.56 4.23 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.724 2.282 . . . . 0.0 112.367 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . 0.416 ' CZ ' HD23 ' B' ' 170' ' ' LEU . 11.4 t80 -56.51 -34.22 66.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.955 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.15 -51.45 69.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.69 -32.91 74.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -50.06 71.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.416 HD23 ' CZ ' ' B' ' 166' ' ' TYR . 0.2 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.9 -37.96 77.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.43 -51.66 68.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.937 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -39.34 81.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.867 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -41.59 77.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.15 75.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.87 71.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -64.77 -36.97 86.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.817 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . 0.589 HD23 ' N ' ' B' ' 179' ' ' GLU . 1.3 tt -68.59 -51.37 43.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.897 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . 0.589 ' N ' HD23 ' B' ' 178' ' ' LEU . 10.0 pt-20 -65.45 -42.19 92.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.945 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.19 77.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.084 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -35.35 77.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -31.51 70.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.952 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -55.85 24.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.81 -25.82 63.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -53.54 -31.97 45.17 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.464 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -63.83 -49.9 64.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.495 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.86 -21.65 43.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.071 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 19.9 ttp180 -71.89 -29.11 64.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.883 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -49.9 75.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.39 -49.02 68.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.114 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -62.22 -34.2 76.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.867 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.2 -51.56 65.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.917 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -54.02 -48.8 70.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.835 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.82 69.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.123 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -76.73 -42.34 41.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.909 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.71 73.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 39.9 p -60.12 -46.82 88.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.084 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.87 -35.83 75.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -61.21 -54.32 45.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.821 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.07 -28.71 64.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.93 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 2.3 m -56.54 -51.27 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.81 30.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.117 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 1.1 tt -53.84 -57.28 11.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.5 m -54.43 -35.98 63.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.97 -47.81 81.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.81 -27.78 44.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.904 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -65.46 -23.35 66.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.151 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.523 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.0 OUTLIER -64.47 -64.01 3.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.574 0.702 . . . . 0.0 110.923 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -26.89 27.36 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 0.0 112.331 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.68 -31.69 59.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.099 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 5.6 tt -71.13 -40.97 71.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.57 -51.12 66.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.903 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.94 -29.87 58.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.02 -45.69 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.91 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . 0.64 ' O ' HD13 ' B' ' 219' ' ' LEU . 8.6 mtp180 -73.01 -39.83 65.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -68.23 -25.07 65.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.547 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -80.69 -49.94 5.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.472 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -63.81 -28.01 69.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.866 0.365 . . . . 0.0 110.896 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.64 HD13 ' O ' ' B' ' 215' ' ' ARG . 1.4 mp -50.45 -63.44 1.84 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.615 0.721 . . . . 0.0 110.921 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.513 ' CD ' ' CB ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.82 -46.51 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.662 2.242 . . . . 0.0 112.338 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.547 HG23 ' O ' ' B' ' 217' ' ' GLY . 91.9 t -54.56 -55.08 17.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.124 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.08 -31.79 70.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.896 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.702 ' O ' HG23 ' B' ' 227' ' ' VAL . 22.0 tt0 -69.1 -36.17 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -47.65 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -61.24 -44.18 97.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.864 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -40.33 95.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.702 HG23 ' O ' ' B' ' 223' ' ' GLU . 38.6 t -55.39 -48.34 77.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.085 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 2.2 t -59.07 -50.06 75.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.861 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.04 -35.33 79.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.541 HD13 ' O ' ' B' ' 230' ' ' LEU . 0.3 OUTLIER -64.1 -34.14 77.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 67.3 m -73.62 -31.41 63.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.09 -51.57 56.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.077 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.7 pp -64.92 -37.95 89.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -72.41 -34.93 68.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.92 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.38 -50.01 56.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -58.87 -47.1 86.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . . . . . . . . . 35.3 m -67.9 -39.86 83.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.131 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -56.61 -54.18 48.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -48.98 77.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 58.9 tp -58.08 -33.52 69.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.889 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.83 -22.14 31.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.873 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 2.2 m 73.64 -68.77 0.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.908 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.941 0.4 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 58.7 p -148.12 172.31 14.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.106 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -90.67 47.79 1.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.876 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 t -64.34 -37.67 88.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.838 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.3 tptm -76.41 -46.47 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -38.68 91.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.931 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -45.32 62.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -42.46 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.848 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.521 ' O ' HG23 ' A' ' 68' ' ' THR . 9.1 pt20 -78.06 -22.33 49.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -38.88 69.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.959 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -52.19 177.43 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.463 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -4.79 14.73 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.288 . . . . 0.0 112.33 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 m -64.44 -28.48 44.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.148 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER -43.98 -33.74 1.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.154 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -58.23 -50.03 75.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -72.53 -27.54 62.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -62.91 -55.15 28.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -71.02 -34.78 71.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.939 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.31 -53.71 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 -65.21 -39.21 92.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.82 -54.91 39.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.929 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.58 -36.09 77.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -50.73 70.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.06 -31.44 61.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.934 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.662 HG23 HD23 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -59.01 -22.07 60.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.149 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.58 -34.18 17.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.84 -27.04 19.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.476 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.662 HD23 HG23 ' A' ' 79' ' ' THR . 2.0 pp -48.36 -35.65 12.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.789 0.328 . . . . 0.0 110.93 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -60.27 -50.21 74.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.887 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -45.08 96.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -49.06 73.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.13 -40.78 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -50.66 73.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.78 -46.27 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 93' ' ' VAL . 22.2 t0 -55.6 -46.15 77.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -57.48 -50.24 73.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -48.58 69.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.21 -36.68 84.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 89' ' ' ASP . 70.5 t -64.99 -32.03 56.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -73.92 -52.64 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.92 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.85 -33.66 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.103 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -77.89 -32.85 52.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 93' ' ' VAL . 2.0 t -58.35 -43.59 86.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.178 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.538 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 2.4 mm-40 -43.59 -65.21 0.61 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.701 . . . . 0.0 110.866 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.5 Cg_endo -69.74 -32.15 19.24 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.712 2.274 . . . . 0.0 112.306 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.404 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 13.2 t80 -58.58 -25.02 62.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.929 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.58 -51.07 25.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -33.0 74.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.872 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -47.54 68.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.825 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.91 -52.46 64.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -64.58 -47.27 79.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.914 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -60.31 -22.96 63.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -74.71 -46.87 34.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.942 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -29.79 70.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -68.64 -54.61 15.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.896 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.38 -35.12 73.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.849 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -70.41 -30.48 67.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -71.43 -53.26 14.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.916 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.36 -35.03 79.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.8 tp -76.15 -26.12 55.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.706 ' O ' HG23 ' A' ' 119' ' ' VAL . 5.1 t80 -66.48 -54.18 26.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.951 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -72.96 -34.05 66.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.846 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 143' ' ' PRO . 43.1 tt0 -70.34 -23.79 62.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.93 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -89.04 -45.05 9.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.87 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 115' ' ' TYR . 99.5 t -61.33 -32.12 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.538 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 0.3 OUTLIER -56.22 -64.69 2.1 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.626 0.727 . . . . 0.0 110.845 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.538 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.5 Cg_endo -69.76 -52.02 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.693 2.262 . . . . 0.0 112.326 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.36 -63.02 1.2 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.57 -32.38 2.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.458 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.31 -44.09 47.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.354 . . . . 0.0 110.927 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.56 -36.86 73.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.872 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -48.33 66.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.916 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -68.82 -37.75 79.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.2 -52.86 16.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.849 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -62.42 -41.37 98.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.64 -39.87 92.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.092 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -62.23 -53.12 59.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.12 61.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -60.58 -45.16 94.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.83 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.11 -53.72 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.37 -52.64 20.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.871 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.98 -44.4 96.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.54 -41.89 86.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.941 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -65.54 -48.26 73.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 21.3 m -55.56 -42.46 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.129 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.88 -32.44 51.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.15 -19.63 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.8 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.68 -62.38 6.0 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.607 0.718 . . . . 0.0 111.121 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.8 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 53.1 Cg_endo -69.86 -47.12 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 0.0 112.327 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . 0.5 ' O ' HD13 ' A' ' 170' ' ' LEU . 19.7 m-30 -55.92 -27.44 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -51.35 64.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.846 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.32 -34.51 78.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -51.96 21.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.932 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 166' ' ' TYR . 8.8 mp -61.14 -49.45 77.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -61.22 -33.71 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.46 -52.33 64.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.61 -43.1 69.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.97 -50.63 72.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.76 -32.81 74.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.136 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.25 -42.02 60.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.068 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -73.77 -32.09 63.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.69 -49.54 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.948 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.23 -35.59 71.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -70.02 -47.89 60.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.16 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -59.55 -43.32 93.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -32.43 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.888 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -51.03 68.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.92 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -69.08 -26.32 64.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.881 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.56 42.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.453 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.43 -31.9 36.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.462 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.47 -25.62 41.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -38.23 64.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -37.26 80.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.957 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.24 -48.78 40.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -47.99 81.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.29 -44.04 95.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.896 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.08 -47.44 71.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.861 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.49 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -76.07 -51.31 12.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.845 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.63 -45.66 78.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . 0.507 HG21 HD13 ' B' ' 240' ' ' LEU . 95.3 m -59.59 -46.86 87.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.66 -38.65 91.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.59 -40.62 83.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.865 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -32.08 65.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.891 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . 0.727 ' OG ' HG23 ' B' ' 237' ' ' THR . 0.5 OUTLIER -57.79 -50.99 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.854 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.29 -51.27 59.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.186 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.77 -50.23 68.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.82 -35.23 68.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.72 -47.81 84.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -31.75 56.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.34 63.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.085 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.504 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.5 OUTLIER -60.41 -63.12 4.66 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.601 0.715 . . . . 0.0 110.916 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.504 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.73 -27.65 26.37 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.68 2.254 . . . . 0.0 112.364 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.41 -31.82 58.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.29 -36.39 68.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.84 -50.91 65.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -73.68 -34.0 64.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.6 tt -61.46 -49.29 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.93 -36.1 83.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -57.03 -48.79 77.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.553 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -67.6 -29.52 74.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.438 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.19 -32.51 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.921 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.4 OUTLIER -49.42 -60.79 4.27 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.602 0.715 . . . . 0.0 110.947 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.6 Cg_endo -69.82 -39.01 6.89 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.679 2.253 . . . . 0.0 112.333 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 217' ' ' GLY . 49.0 t -58.17 -55.33 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 -34.42 73.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' A' ' 227' ' ' VAL . 0.1 OUTLIER -66.58 -34.78 78.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -48.32 82.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.17 -42.5 79.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -63.08 -46.58 86.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 223' ' ' GLU . 40.1 t -56.89 -39.91 68.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.129 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 28.7 m -58.67 -50.26 74.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -61.25 -36.76 80.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.912 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.482 ' HA ' HD21 ' A' ' 233' ' ' LEU . 1.8 tp -63.71 -34.39 77.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.951 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -30.82 66.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.31 -51.37 53.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.111 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 230' ' ' LEU . 1.0 OUTLIER -67.56 -44.79 77.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.867 -179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -35.81 79.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.13 -48.9 66.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -54.16 -40.72 67.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . 0.706 HG23 ' OG ' ' B' ' 201' ' ' SER . 97.1 m -73.09 -40.23 65.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.54 -54.83 39.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -37.41 78.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.854 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.474 HD13 HG21 ' B' ' 197' ' ' THR . 2.3 tp -57.68 -38.16 74.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -172.99 87.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . . . . . . . . . 1.5 m -51.39 128.83 23.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.148 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.888 -179.975 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.958 0.408 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 61.3 p -148.23 172.27 14.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -90.67 47.69 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.4 t -64.09 -37.7 88.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.888 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 tptm -76.4 -46.4 27.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -38.67 91.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.891 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -45.42 62.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.57 -42.42 92.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.904 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.521 ' O ' HG23 ' B' ' 68' ' ' THR . 9.1 pt20 -77.98 -22.41 49.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.913 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -39.0 69.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.888 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -52.17 177.48 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.491 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 -4.83 14.79 Favored 'Trans proline' 0 N--CA 1.465 -0.178 0 C-N-CA 122.721 2.281 . . . . 0.0 112.367 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 m -64.36 -28.56 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.105 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . 0.521 HG23 ' O ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -44.01 -33.68 1.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.138 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -58.21 -50.08 74.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.924 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -72.5 -27.66 62.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.909 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -62.79 -55.12 29.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -71.08 -34.68 71.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.26 -53.82 26.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.847 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -65.1 -39.36 93.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.65 -54.92 39.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -60.75 -35.97 77.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.46 -50.69 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.887 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -75.12 -31.4 61.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . 0.653 HG23 HD23 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -58.92 -22.07 59.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.145 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -49.7 -34.25 18.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -51.89 -27.09 20.0 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.653 HD23 HG23 ' B' ' 79' ' ' THR . 2.0 pp -48.46 -35.58 13.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 0.0 110.903 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 64.6 ttt-85 -60.3 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -45.04 96.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.89 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.08 73.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.902 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 4.0 mmm -59.27 -40.62 86.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.94 -50.62 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -58.95 -46.43 88.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.699 ' O ' HG23 ' B' ' 93' ' ' VAL . 22.1 t0 -55.38 -46.4 76.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.873 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 60.6 mt -57.46 -50.1 74.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -48.62 69.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.41 -36.58 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.901 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 89' ' ' ASP . 73.6 t -65.12 -32.07 56.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.16 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -74.38 -53.07 10.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.921 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.0 72.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -78.22 -33.05 50.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.4 t -55.13 -46.79 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.568 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 2.6 mm-40 -42.75 -66.52 0.42 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.663 0.744 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.568 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.78 -31.54 20.24 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.698 2.265 . . . . 0.0 112.305 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.443 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 12.7 t80 -58.17 -24.19 58.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.52 -50.02 16.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.914 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -33.04 70.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.86 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -46.76 65.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -53.42 56.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -63.51 -47.72 80.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.937 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 mttp -61.06 -22.21 64.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -72.74 -48.08 41.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.898 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -63.4 -31.41 72.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.8 -55.82 20.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.1 -34.44 71.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.902 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.39 -32.75 70.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.72 -53.45 18.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.4 -35.84 82.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.908 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -76.22 -25.96 55.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.877 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.696 ' O ' HG23 ' B' ' 119' ' ' VAL . 5.4 t80 -65.68 -54.62 25.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -73.47 -33.59 64.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.867 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.421 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 44.0 tt0 -70.36 -23.05 62.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 ttmt -90.83 -45.17 8.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.905 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.696 HG23 ' O ' ' B' ' 115' ' ' TYR . 87.6 t -60.8 -32.46 52.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.532 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 0.2 OUTLIER -58.15 -64.47 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.648 0.737 . . . . 0.0 110.864 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.532 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 54.2 Cg_endo -69.75 -50.41 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.712 2.275 . . . . 0.0 112.362 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -64.74 0.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.922 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.65 -31.96 2.75 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.496 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.1 -46.06 30.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.877 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.15 -41.0 77.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -52.21 58.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -64.43 -37.36 87.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.847 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.55 -51.81 46.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.875 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -64.59 -35.19 80.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 156' ' ' VAL . . . -63.88 -45.63 88.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.065 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -60.04 -52.53 64.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -55.5 -54.54 42.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -61.52 -40.47 94.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.854 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 152' ' ' ALA . 2.6 t -60.03 -52.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.95 -51.26 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -61.26 -45.61 93.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.073 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.26 -40.21 81.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.937 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -66.15 -47.83 72.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.895 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 21.4 m -56.14 -42.64 77.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.132 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -77.37 -32.84 55.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 4.3 tt -70.48 -19.22 62.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.814 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -60.02 -62.08 6.61 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.535 0.683 . . . . 0.0 111.043 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.5 Cg_endo -69.81 -46.52 1.18 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.669 2.246 . . . . 0.0 112.312 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . 0.506 ' O ' HD13 ' B' ' 170' ' ' LEU . 19.6 m-30 -56.68 -27.79 59.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.915 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.1 66.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.815 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.39 -52.03 20.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.506 HD13 ' O ' ' B' ' 166' ' ' TYR . 8.9 mp -61.04 -49.17 78.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -61.46 -33.72 74.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.874 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.66 -52.16 65.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.892 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -70.16 -43.57 70.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 7.4 tp -60.82 -50.46 73.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.9 -32.87 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.079 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.97 60.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.101 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -73.84 -31.95 63.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.867 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.48 -48.74 66.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.11 -38.88 72.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.884 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -67.03 -46.96 72.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 22.8 tp -60.85 -42.18 97.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.926 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -33.07 67.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -50.54 69.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -69.09 -26.39 64.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -52.43 -34.55 42.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -52.36 -31.9 36.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -79.35 -25.76 42.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.809 0.338 . . . . 0.0 111.11 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -38.31 64.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -37.27 80.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -72.16 -48.79 40.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -47.74 82.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -60.49 -43.96 96.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.947 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.13 -47.51 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.841 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.15 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -76.01 -51.25 12.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.73 -45.7 77.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.071 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . 0.474 HG21 HD13 ' A' ' 240' ' ' LEU . 94.9 m -59.58 -46.79 87.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.132 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -63.75 -38.6 91.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.848 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -58.62 -40.66 83.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.94 -32.0 64.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . 0.706 ' OG ' HG23 ' A' ' 237' ' ' THR . 0.5 OUTLIER -57.78 -50.97 71.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.876 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 2.6 m -66.34 -51.24 59.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.184 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 33.8 tp -54.82 -50.2 69.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 82.2 p -56.89 -35.26 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.65 -47.84 84.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -31.86 56.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.29 -20.24 63.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.12 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.502 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.5 OUTLIER -60.55 -63.18 4.6 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 0.0 110.892 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.502 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.5 Cg_endo -69.71 -27.74 26.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.676 2.251 . . . . 0.0 112.365 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -76.37 -31.77 58.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.088 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.5 tt -72.21 -36.28 69.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.905 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.81 -50.86 65.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.53 -34.2 65.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.824 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.38 -49.36 77.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -64.78 -36.16 83.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.84 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -57.03 -48.82 77.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.916 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -67.54 -29.46 74.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.508 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.25 -32.56 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.331 . . . . 0.0 110.883 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.4 OUTLIER -49.38 -60.86 4.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.597 0.713 . . . . 0.0 110.927 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 54.1 Cg_endo -69.69 -39.08 7.09 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.717 2.278 . . . . 0.0 112.383 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 49.0 t -58.21 -55.31 23.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.136 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 -34.38 73.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.562 ' O ' HG23 ' B' ' 227' ' ' VAL . 0.1 OUTLIER -66.63 -34.74 78.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.63 -48.34 82.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.866 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.13 -42.62 79.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.08 -46.53 86.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.562 HG23 ' O ' ' B' ' 223' ' ' GLU . 39.8 t -56.88 -39.92 68.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.142 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 28.5 m -58.73 -50.21 74.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.874 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.26 -36.77 80.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.475 ' HA ' HD21 ' B' ' 233' ' ' LEU . 1.8 tp -63.72 -34.31 77.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.55 -30.78 66.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -67.4 -51.28 53.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.073 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.475 HD21 ' HA ' ' B' ' 230' ' ' LEU . 1.0 OUTLIER -67.61 -44.75 77.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.923 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.04 -35.73 79.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.931 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -67.2 -48.91 66.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.838 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -54.22 -40.7 67.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . 0.727 HG23 ' OG ' ' A' ' 201' ' ' SER . 96.9 m -73.07 -40.24 65.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.153 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 1.6 mmpp? -55.61 -54.75 40.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.903 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.06 -37.35 78.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.507 HD13 HG21 ' A' ' 197' ' ' THR . 2.2 tp -57.58 -38.24 74.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.869 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -172.92 87.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 1.5 m -51.48 128.79 23.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.156 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 179.989 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.8 m . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.929 0.395 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.7 t -71.98 -35.76 69.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.164 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -118.94 37.07 4.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.1 -42.67 63.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.848 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -69.8 -41.04 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -45.49 93.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.908 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -65.85 -47.12 76.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.878 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -57.54 -43.2 84.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -77.51 -24.37 50.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.507 HD13 ' C ' ' A' ' 64' ' ' LEU . 3.5 tm? -53.98 -41.66 68.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.98 73.48 0.97 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.459 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -32.13 19.12 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.659 2.239 . . . . 0.0 112.336 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 27.0 m -55.59 -33.36 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.5 p -67.49 -47.34 70.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.098 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -54.8 -47.91 73.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.899 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.7 -30.42 69.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -59.28 5.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.902 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -68.4 -44.14 75.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -56.46 -49.53 74.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.85 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -63.02 -46.43 87.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -56.5 21.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.918 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.06 -34.9 72.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -56.59 -51.33 69.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -32.07 65.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.0 m -62.21 -24.75 67.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.158 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -50.91 -33.13 22.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.03 -26.84 9.24 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.508 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -47.4 -40.7 18.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.626 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.1 mtt-85 -59.44 -49.83 76.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.12 -47.39 85.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.75 -49.69 67.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -40.37 82.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -59.88 -50.78 72.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.835 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.7 -46.21 87.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.666 ' O ' HG23 ' A' ' 93' ' ' VAL . 5.1 t0 -55.47 -47.66 75.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.83 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -48.1 80.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.55 -47.57 76.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -36.58 83.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.666 HG23 ' O ' ' A' ' 89' ' ' ASP . 72.9 t -66.58 -31.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.162 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -52.75 10.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.83 -33.71 75.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -77.35 -33.51 55.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 93' ' ' VAL . 1.4 t -59.5 -42.15 87.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.103 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.536 ' CB ' ' CD ' ' A' ' 99' ' ' PRO . 0.1 OUTLIER -44.92 -64.73 0.78 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.611 0.72 . . . . 0.0 110.918 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 98' ' ' GLN . 53.7 Cg_endo -69.78 -31.52 20.25 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.679 2.253 . . . . 0.0 112.34 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.423 ' HB3' ' HA ' ' A' ' 97' ' ' VAL . 16.4 t80 -60.78 -24.88 66.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.937 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -72.23 -50.8 24.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.945 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -65.66 -34.24 77.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.858 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -47.32 77.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -52.26 66.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.84 -46.9 82.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -64.25 -22.58 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.902 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -71.46 -45.54 62.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.887 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -25.67 61.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.936 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -65.47 -59.53 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.922 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -67.83 -34.31 76.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.2 -31.46 68.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.916 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -68.41 -54.11 19.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.87 -34.74 78.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.929 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.74 -26.19 54.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.94 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.674 ' O ' HG23 ' A' ' 119' ' ' VAL . 4.6 t80 -64.35 -54.57 30.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -33.28 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -71.34 -24.92 62.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -87.18 -47.07 9.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.674 HG23 ' O ' ' A' ' 115' ' ' TYR . 72.7 t -60.89 -31.27 49.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.158 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.537 ' CB ' ' CD ' ' A' ' 143' ' ' PRO . 3.7 mt-10 -54.74 -64.7 1.77 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.583 0.706 . . . . 0.0 110.838 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.537 ' CD ' ' CB ' ' A' ' 120' ' ' GLU . 53.7 Cg_endo -69.77 -54.96 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.41 -62.48 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -46.01 -31.52 4.32 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.498 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.83 -42.77 57.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.796 0.331 . . . . 0.0 110.869 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.19 -35.26 66.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 16.6 mtp -67.1 -48.92 66.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -37.54 79.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.841 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -71.0 -52.05 21.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -63.28 -35.65 81.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.935 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.608 ' O ' HG12 ' A' ' 156' ' ' VAL . . . -64.77 -41.25 96.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.063 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -62.76 -47.97 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.08 -32.57 67.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -69.67 -50.43 44.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.608 HG12 ' O ' ' A' ' 152' ' ' ALA . 14.6 p -66.26 -41.2 88.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.443 ' N ' HG13 ' A' ' 156' ' ' VAL . 25.6 t70 -53.39 -52.86 57.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.37 -48.36 75.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.2 -38.55 73.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.928 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -44.08 78.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.61 -42.99 79.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -80.95 -29.77 35.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 34.8 tp -70.69 -18.2 62.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.804 ' HB3' ' HD3' ' A' ' 165' ' ' PRO . . . -59.95 -63.11 4.63 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.572 0.701 . . . . 0.0 111.106 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.804 ' HD3' ' HB3' ' A' ' 164' ' ' ALA . 54.3 Cg_endo -69.71 -44.88 1.85 Allowed 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.722 2.281 . . . . 0.0 112.356 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' TYR . . . . . 0.57 ' CZ ' HD22 ' A' ' 170' ' ' LEU . 15.3 t80 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.907 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.6 -49.18 72.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.17 -46.66 87.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.3 -52.33 54.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.57 HD22 ' CZ ' ' A' ' 166' ' ' TYR . 17.8 tp -58.59 -47.69 83.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 8.7 mmp_? -56.56 -38.31 71.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.929 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.62 -49.14 77.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -61.03 -47.72 85.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.917 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.92 -46.01 89.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.06 -36.22 65.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -74.22 -34.7 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -33.6 76.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 8.9 tt -73.61 -49.39 26.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.932 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.5 -50.3 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.68 73.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.108 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.02 -35.83 79.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -65.25 -27.8 68.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -53.4 -56.6 15.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.58 -48.36 77.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -56.05 -32.28 59.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.493 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.46 71.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.25 -54.24 7.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 0.0 111.121 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -55.75 -28.62 56.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 11.4 tp -56.09 -47.32 78.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.56 58.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.08 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -60.32 -34.16 73.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.51 -47.25 79.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.91 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.51 -47.63 72.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.55 -30.71 71.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.12 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -49.67 20.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.34 87.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.116 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.02 -47.03 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.136 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.72 -39.49 91.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.85 -38.03 77.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.842 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -34.17 65.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.948 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' SER . . . . . 0.647 ' HB3' HG23 ' B' ' 237' ' ' THR . 8.4 m -57.15 -50.74 71.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.819 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.37 -51.43 60.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.143 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.53 -47.76 72.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.914 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 24.6 p -59.33 -33.71 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.801 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.57 -46.97 88.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.56 -32.26 58.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.6 -20.35 63.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.498 ' CB ' ' CD ' ' A' ' 209' ' ' PRO . 0.1 OUTLIER -59.85 -62.82 5.12 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.593 0.711 . . . . 0.0 110.929 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 208' ' ' LYS . 53.8 Cg_endo -69.77 -27.34 26.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.693 2.262 . . . . 0.0 112.352 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.62 -35.59 60.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.126 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.75 -34.87 74.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.954 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -51.05 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -71.25 -34.65 70.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.88 -50.34 74.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -36.35 83.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -56.81 -48.56 77.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.954 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . 0.575 ' O ' HG23 ' A' ' 221' ' ' VAL . . . -66.64 -29.26 74.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.51 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.03 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 220' ' ' PRO . 0.6 OUTLIER -48.77 -60.73 4.13 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.627 0.727 . . . . 0.0 110.938 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 219' ' ' LEU . 53.9 Cg_endo -69.75 -38.56 7.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.68 2.253 . . . . 0.0 112.367 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 217' ' ' GLY . 48.0 t -58.17 -54.22 35.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.133 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -35.0 74.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.91 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' GLU . . . . . 0.627 ' O ' HG13 ' A' ' 227' ' ' VAL . 2.2 mt-10 -63.49 -37.29 86.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.899 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 -45.81 92.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.5 -36.46 68.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.64 -51.78 56.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 223' ' ' GLU . 30.0 m -57.62 -35.97 52.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.106 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.58 -51.37 70.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.7 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' LEU . . . . . 0.579 HD13 HD11 ' A' ' 233' ' ' LEU . 2.9 mm? -63.48 -33.71 76.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -31.45 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.79 -51.7 52.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' LEU . . . . . 0.579 HD11 HD13 ' A' ' 230' ' ' LEU . 0.9 OUTLIER -67.9 -46.08 72.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.935 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.47 -36.22 75.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.22 -48.78 72.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -54.04 -39.84 66.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.939 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 237' ' ' THR . . . . . 0.699 HG23 ' HB3' ' B' ' 201' ' ' SER . 78.5 m -65.58 -46.45 79.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -55.07 37.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.867 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -44.85 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 240' ' ' LEU . . . . . 0.665 HD23 ' OG1' ' A' ' 242' ' ' THR . 0.6 OUTLIER -56.78 -35.03 68.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.911 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 74.73 61.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.907 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 242' ' ' THR . . . . . 0.665 ' OG1' HD23 ' A' ' 240' ' ' LEU . 0.2 OUTLIER -127.36 39.21 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 243' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.942 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.958 0.408 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 9.7 t -71.98 -35.8 69.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.101 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -119.06 37.56 4.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.855 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.68 -42.64 64.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.871 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -69.94 -41.42 74.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.88 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.84 -45.89 91.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.92 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -65.66 -47.3 75.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -57.14 -43.43 82.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -77.51 -24.11 50.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.492 HD13 ' C ' ' B' ' 64' ' ' LEU . 3.4 tm? -53.91 -41.1 67.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.96 73.24 0.96 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.482 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -32.08 19.42 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.705 2.27 . . . . 0.0 112.348 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 25.2 m -55.37 -35.8 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 16.6 p -66.1 -42.23 89.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -58.02 -52.77 64.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.54 -28.9 69.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -62.61 1.75 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.892 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' TRP . . . . . . . . . . . . . 25.6 p-90 -67.46 -32.84 73.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.48 -52.03 60.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.864 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -63.28 -43.39 98.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.898 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -56.84 16.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.15 -34.96 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -56.65 -51.32 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.931 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -32.21 66.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' THR . . . . . . . . . . . . . 95.8 m -62.02 -24.86 67.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.12 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -51.06 -33.33 25.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.817 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.15 -26.93 9.71 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.437 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.62 HD23 ' N ' ' B' ' 83' ' ' ARG . 0.0 OUTLIER -47.38 -40.54 17.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.911 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ARG . . . . . 0.62 ' N ' HD23 ' B' ' 82' ' ' LEU . 5.1 mtt-85 -59.58 -49.77 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.26 -47.26 86.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -53.81 -49.7 67.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -40.05 81.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.878 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 51.4 m -60.08 -50.59 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.83 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -58.89 -46.28 88.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.681 ' O ' HG23 ' B' ' 93' ' ' VAL . 5.0 t0 -55.29 -47.92 74.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.895 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.55 -47.58 81.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -55.64 -47.45 76.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 -36.65 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 89' ' ' ASP . 78.2 t -66.54 -31.23 52.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -53.02 9.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.89 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.43 -34.74 75.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.082 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 61.3 mmtt -77.86 -33.96 51.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 93' ' ' VAL . 1.0 OUTLIER -56.02 -45.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.149 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.559 ' CB ' ' CD ' ' B' ' 99' ' ' PRO . 0.2 OUTLIER -44.08 -66.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.592 0.71 . . . . 0.0 110.952 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.559 ' CD ' ' CB ' ' B' ' 98' ' ' GLN . 53.6 Cg_endo -69.81 -30.48 21.99 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.668 2.245 . . . . 0.0 112.313 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' B' ' 97' ' ' VAL . 11.4 t80 -60.89 -24.07 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mp -76.33 -50.6 13.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -60.99 -34.66 75.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.859 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -47.22 72.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.881 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -52.4 65.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -63.96 -47.59 79.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -63.06 -22.11 66.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 23.2 tptt -72.34 -46.49 55.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.856 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -26.41 63.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -65.98 -59.98 3.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.83 -34.56 78.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.34 -30.42 67.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -68.81 -54.13 17.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -66.65 -34.45 77.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.71 -26.1 54.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' TYR . . . . . 0.655 ' O ' HG23 ' B' ' 119' ' ' VAL . 6.2 t80 -65.85 -54.2 29.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 -33.35 65.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.833 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.408 ' O ' ' CD ' ' B' ' 143' ' ' PRO . 56.6 tt0 -71.57 -24.12 61.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.906 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -88.47 -48.68 7.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.906 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.655 HG23 ' O ' ' B' ' 115' ' ' TYR . 70.5 t -59.88 -31.54 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.088 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' CB ' ' CD ' ' B' ' 143' ' ' PRO . 3.7 mt-10 -55.59 -64.64 2.01 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.628 0.728 . . . . 0.0 110.88 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' B' ' 120' ' ' GLU . 53.7 Cg_endo -69.81 -52.73 0.31 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.71 2.274 . . . . 0.0 112.304 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.47 -63.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -44.74 -31.25 2.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -77.59 -45.78 24.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 0.0 110.893 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -68.7 -46.64 68.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.94 -51.82 65.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -60.52 -42.14 95.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -66.46 -51.4 57.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 43.7 ttm-85 -60.86 -32.08 71.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.838 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.666 ' O ' HG12 ' B' ' 156' ' ' VAL . . . -64.76 -47.83 76.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -58.81 -45.82 89.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.868 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -72.3 -33.52 67.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.09 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -69.0 -50.36 49.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' VAL . . . . . 0.666 HG12 ' O ' ' B' ' 152' ' ' ALA . 7.6 p -65.17 -41.13 90.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.15 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' ASP . . . . . 0.408 ' N ' HG13 ' B' ' 156' ' ' VAL . 25.7 t70 -53.26 -52.68 58.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.825 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -64.69 -48.73 73.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.076 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -57.16 -37.92 72.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -44.24 77.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.849 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' THR . . . . . . . . . . . . . 10.4 m -56.71 -42.41 79.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -81.43 -29.77 33.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 35.1 tp -70.86 -18.29 62.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.949 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' B' ' 165' ' ' PRO . . . -59.69 -62.96 4.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.589 0.709 . . . . 0.0 111.123 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' B' ' 164' ' ' ALA . 53.8 Cg_endo -69.79 -44.0 2.31 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.703 2.269 . . . . 0.0 112.35 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' TYR . . . . . 0.582 ' CE2' HD22 ' B' ' 170' ' ' LEU . 15.8 t80 -58.41 -27.76 64.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' SER . . . . . . . . . . . . . 1.1 m -64.19 -48.74 74.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -62.1 -47.28 85.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.872 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.09 -52.26 56.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.854 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' LEU . . . . . 0.582 HD22 ' CE2' ' B' ' 166' ' ' TYR . 17.0 tp -58.47 -48.32 81.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 8.8 mmp_? -56.5 -37.33 70.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -45.34 91.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.89 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' ARG . . . . . . . . . . . . . 5.6 ttm-85 -63.73 -47.58 80.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.842 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.28 -43.58 94.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.22 -36.99 69.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -73.94 -34.62 64.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.135 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -33.57 76.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . 9.0 tt -73.49 -48.98 29.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.939 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.59 56.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.864 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -55.86 -49.45 73.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.64 -36.11 81.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.2 -27.73 68.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.922 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -53.48 -56.29 18.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.66 -46.84 83.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.906 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' GLY . . . . . . . . . . . . . . . -57.43 -32.45 64.36 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.503 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' GLY . . . . . . . . . . . . . . . -68.99 -43.7 71.55 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.537 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.14 -54.11 7.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -55.77 -28.57 56.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.97 -47.77 77.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.911 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -69.66 -48.56 59.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.25 -34.09 73.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.934 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -64.48 -47.28 79.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.923 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -54.5 -47.85 72.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.86 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.33 -30.71 71.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.064 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -49.76 20.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.07 -39.19 86.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' THR . . . . . . . . . . . . . 65.5 m -61.0 -46.99 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.124 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.99 -39.25 90.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.93 -38.04 78.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.21 -34.22 65.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.946 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . 0.699 ' HB3' HG23 ' A' ' 237' ' ' THR . 8.4 m -57.1 -50.67 72.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 3.0 p -65.44 -51.35 60.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.118 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -47.86 72.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.969 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 24.3 p -59.35 -33.53 71.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.856 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.58 -47.01 88.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.915 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -32.41 58.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.917 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.49 -20.25 63.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.51 ' CB ' ' CD ' ' B' ' 209' ' ' PRO . 0.1 OUTLIER -60.0 -62.92 4.92 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.589 0.709 . . . . 0.0 110.888 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' PRO . . . . . 0.51 ' CD ' ' CB ' ' B' ' 208' ' ' LYS . 54.2 Cg_endo -69.77 -27.13 26.79 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.717 2.278 . . . . 0.0 112.347 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -75.81 -35.65 59.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.121 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 18.4 mt -69.66 -34.7 74.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.941 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.47 -50.94 64.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -71.21 -34.79 71.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.858 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.72 -50.53 73.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -36.31 83.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -56.76 -48.6 77.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . 0.565 ' O ' HG23 ' B' ' 221' ' ' VAL . . . -66.59 -29.24 74.44 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.526 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 7.9 tp -66.08 -33.2 75.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 219' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' B' ' 220' ' ' PRO . 0.6 OUTLIER -48.7 -60.77 4.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.643 0.735 . . . . 0.0 110.927 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 220' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 219' ' ' LEU . 53.5 Cg_endo -69.78 -38.58 7.56 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.677 2.251 . . . . 0.0 112.339 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 221' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 217' ' ' GLY . 47.7 t -58.09 -54.28 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 222' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -35.12 74.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 223' ' ' GLU . . . . . 0.628 ' O ' HG13 ' B' ' 227' ' ' VAL . 2.2 mt-10 -63.35 -37.17 86.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.921 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . 0.41 ' O ' HG22 ' B' ' 227' ' ' VAL . 1.5 m -60.51 -45.81 92.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 225' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -72.45 -36.47 68.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 226' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -65.61 -51.76 57.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.628 HG13 ' O ' ' B' ' 223' ' ' GLU . 30.9 m -57.6 -35.97 52.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.151 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -51.38 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.72 -38.12 89.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.932 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 230' ' ' LEU . . . . . 0.587 HD13 HD11 ' B' ' 233' ' ' LEU . 2.9 mm? -63.53 -33.68 76.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 231' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -31.37 67.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -66.81 -51.65 53.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.122 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 233' ' ' LEU . . . . . 0.587 HD11 HD13 ' B' ' 230' ' ' LEU . 0.9 OUTLIER -67.97 -46.09 72.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 234' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.4 -36.36 75.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 235' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -65.12 -48.76 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 236' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -53.98 -39.88 66.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.918 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 237' ' ' THR . . . . . 0.647 HG23 ' HB3' ' A' ' 201' ' ' SER . 78.3 m -65.6 -46.41 79.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.142 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 238' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -55.08 36.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.865 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -44.83 80.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.895 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.66 HD23 ' OG1' ' B' ' 242' ' ' THR . 0.6 OUTLIER -56.74 -35.03 68.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 241' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 74.78 60.93 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . 0.66 ' OG1' HD23 ' B' ' 240' ' ' LEU . 0.2 OUTLIER -127.13 39.01 3.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.121 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 243' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.905 179.987 . . . . . . . . 0 0 . 1 stop_ save_