data_2lo0_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 2lo0 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.542 0.211 . . . . 1.47 110.954 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.29 -33.92 47.65 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-O 120.779 0.323 . . . . 1.03 110.377 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.445 HG22 HD11 ' B' ' 209' ' ' LEU . 22.3 t -69.89 -19.69 22.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.678 0.751 . . . . 1.08 109.73 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.525 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.21 12.04 10.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.546 -0.752 . . . . 0.9 111.522 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 34.1 p -108.98 146.28 34.12 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.485 0.66 . . . . 1.07 110.562 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.95 -31.57 72.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 2.46 110.012 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.18 -40.5 94.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.4 -0.818 . . . . 1.07 111.427 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.14 -49.98 73.69 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.338 -0.392 . . . . 0.31 109.943 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.82 -29.22 67.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.61 -0.723 . . . . 0.19 111.845 -177.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.38 -48.3 70.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.799 0.333 . . . . 1.23 110.232 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.32 -33.84 73.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 1.37 110.928 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.14 -47.13 86.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.921 -0.581 . . . . 1.03 109.609 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.432 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.6 -32.19 72.76 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.438 -0.347 . . . . 0.75 110.2 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.635 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.02 -41.7 96.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.959 -0.639 . . . . 0.18 111.735 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.14 -41.13 90.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.441 0.638 . . . . 2.18 109.534 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.42 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -63.59 -37.93 89.21 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.094 -0.957 . . . . 1.07 110.434 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -66.76 -42.88 85.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.66 -0.245 . . . . 1.13 110.664 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.635 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 49.7 mt-30 -57.51 -46.07 84.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.878 0.37 . . . . 1.58 111.567 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.96 -41.32 20.97 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.484 0.55 . . . . 2.61 112.484 -175.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.44 HD11 HG22 ' B' ' 192' ' ' VAL . 8.3 mp -86.26 -22.46 26.83 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.049 0.389 . . . . 1.14 112.049 -172.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.53 39.61 17.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.622 -0.717 . . . . 2.74 110.991 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -157.99 117.33 3.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.955 0.407 . . . . 1.12 110.221 -177.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.58 -44.29 82.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.569 -0.741 . . . . 2.32 111.778 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -69.72 -40.67 76.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.532 -0.304 . . . . 2.01 111.142 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -68.31 -40.21 81.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.329 0.585 . . . . 1.48 109.866 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.54 -32.71 74.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.403 -0.817 . . . . 1.03 109.887 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.425 ' O ' HG21 ' A' ' 220' ' ' VAL . 3.9 t-20 -69.76 -44.22 70.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.996 -1.002 . . . . 0.63 110.006 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -56.58 -42.65 79.03 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.132 -0.486 . . . . 2.45 110.389 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 53.7 mt -72.84 -35.18 67.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.656 -0.702 . . . . 1.08 110.502 -177.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . 0.432 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 50.2 ttp180 -57.89 -42.99 85.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.03 0.443 . . . . 1.49 110.271 176.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 60.5 t -71.23 -49.08 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.639 -0.71 . . . . 1.13 109.806 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . 0.4 HD23 ' O ' ' B' ' 225' ' ' ALA . 65.2 tp -57.36 -49.52 75.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.701 -1.136 . . . . 1.09 110.964 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -66.3 -36.92 84.19 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.778 -0.647 . . . . 2.18 110.706 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 88.0 tttt -66.71 -34.54 78.08 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.67 -0.412 . . . . 1.0 110.824 179.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 10.9 mm-40 -75.79 -30.49 59.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.135 0.493 . . . . 2.28 109.822 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.37 -42.94 82.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.592 -0.731 . . . . 0.99 109.482 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.525 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 36.6 t90 -63.28 -36.2 82.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.121 -0.945 . . . . 0.21 110.096 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.7 82.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.263 -0.426 . . . . 2.82 110.626 175.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 14.5 t -76.61 -9.29 58.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.201 -0.454 . . . . 1.85 110.785 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 35.1 t -75.19 -12.03 60.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.193 0.52 . . . . 1.67 110.348 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.695 -0.669 . . . . 2.18 110.355 178.07 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.569 0.223 . . . . 1.46 110.834 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.13 -33.99 48.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 CA-C-O 120.721 0.296 . . . . 1.03 110.269 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . 0.44 HG22 HD11 ' A' ' 209' ' ' LEU . 22.2 t -69.82 -19.68 22.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.573 0.701 . . . . 1.07 109.736 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.521 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.16 11.84 11.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.623 -0.717 . . . . 0.9 111.486 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 34.4 p -108.87 146.17 34.15 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.572 0.701 . . . . 1.06 110.457 -175.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.79 -31.72 72.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.768 -1.105 . . . . 2.46 109.939 176.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.1 -40.29 93.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.518 -0.764 . . . . 1.07 111.487 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.34 -50.1 72.97 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.332 -0.395 . . . . 0.31 109.991 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.71 -29.29 67.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.594 -0.73 . . . . 0.18 111.861 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.3 -48.48 70.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.8 0.333 . . . . 1.25 110.155 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.16 -33.95 74.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.378 -0.374 . . . . 1.37 110.784 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -58.99 -47.16 86.18 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.003 -0.544 . . . . 1.03 109.589 175.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.427 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.67 -32.07 72.48 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 116.459 -0.337 . . . . 0.76 110.328 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.615 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.25 -41.55 96.83 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.968 -0.634 . . . . 0.18 111.594 175.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -66.21 -41.12 90.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.413 0.625 . . . . 2.18 109.509 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.0 mp -63.49 -38.06 89.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.108 -0.951 . . . . 1.07 110.54 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -66.64 -43.16 85.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.672 -0.24 . . . . 1.14 110.552 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 49.7 mt-30 -57.21 -46.13 83.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.429 -0.35 . . . . 1.58 111.588 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -82.09 -41.17 20.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.425 0.528 . . . . 2.62 112.425 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 192' ' ' VAL . 8.4 mp -86.26 -22.68 26.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.982 0.364 . . . . 1.14 111.982 -172.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.45 40.07 17.63 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.909 0.756 . . . . 2.74 110.758 -177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -158.2 117.37 3.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.888 0.375 . . . . 1.11 110.319 -177.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -66.6 -44.28 82.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.604 -0.726 . . . . 2.31 111.801 -177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.75 -41.05 75.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.445 -0.343 . . . . 2.0 111.045 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -67.98 -40.28 83.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.437 0.637 . . . . 1.48 110.002 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.8 74.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 1.04 109.915 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.406 ' O ' HG21 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.56 -44.57 70.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.107 -0.952 . . . . 0.63 110.028 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -56.23 -42.93 78.08 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 116.137 -0.483 . . . . 2.43 110.377 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.2 mt -72.77 -35.04 67.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.689 -0.687 . . . . 1.08 110.578 -177.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . 0.427 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 50.1 ttp180 -57.83 -43.2 85.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.101 0.477 . . . . 1.49 110.18 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 59.6 t -71.16 -49.07 51.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.708 -0.678 . . . . 1.12 109.891 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.3 tp -57.23 -49.75 75.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.756 -1.111 . . . . 1.09 111.035 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -66.24 -36.79 83.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.76 -0.654 . . . . 2.18 110.731 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.551 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 87.9 tttt -66.84 -34.5 77.95 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.663 -0.415 . . . . 1.0 110.795 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 12.0 mm-40 -75.75 -30.2 59.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.095 0.474 . . . . 2.27 109.796 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . 0.4 ' O ' HD23 ' A' ' 221' ' ' LEU . . . -67.64 -42.87 81.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.539 -0.755 . . . . 0.98 109.458 174.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.521 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 36.9 t90 -63.33 -36.23 82.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.207 -0.906 . . . . 0.2 110.151 176.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.99 82.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 2.82 110.386 175.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 19.5 t -76.36 -9.15 58.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.261 -0.427 . . . . 1.85 110.871 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 33.5 t -75.35 -11.81 60.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.057 0.456 . . . . 1.68 110.313 178.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.606 -0.711 . . . . 2.17 110.406 177.712 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 113.28 0.844 . . . . 1.47 113.28 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 14.8 p -86.74 -31.41 6.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.284 -0.567 . . . . 1.03 111.009 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.422 HG21 HD13 ' B' ' 209' ' ' LEU . 28.1 t -68.28 -21.38 26.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.366 0.603 . . . . 1.08 110.231 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.465 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.28 11.36 12.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.99 -0.55 . . . . 0.9 111.354 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 46.1 p -106.32 145.66 31.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.279 0.561 . . . . 1.07 109.998 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -65.45 -32.4 74.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.189 -0.914 . . . . 2.46 109.692 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.76 -37.87 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.366 -0.833 . . . . 1.07 111.745 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -62.68 -50.8 69.72 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.967 -0.383 . . . . 0.31 109.967 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.18 -29.38 67.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.635 -0.711 . . . . 0.19 111.553 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.88 -48.75 70.49 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.028 0.442 . . . . 1.23 110.316 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -72.45 -32.54 66.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 1.37 110.938 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.46 -47.1 85.13 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.037 -0.727 . . . . 1.03 109.037 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.429 ' HB2' ' HD2' ' A' ' 219' ' ' ARG . 49.8 tt0 -66.05 -33.84 76.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.145 -0.479 . . . . 0.75 110.299 176.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.492 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -61.41 -39.82 97.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.829 -0.701 . . . . 0.18 112.068 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.45 -38.64 87.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.542 0.687 . . . . 2.18 109.258 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -65.55 -33.6 76.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.06 -0.973 . . . . 1.07 110.686 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.01 -43.63 87.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.869 0.366 . . . . 1.13 110.476 175.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.492 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 51.4 mt-30 -59.99 -46.99 87.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.989 -0.551 . . . . 1.58 111.532 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.29 -47.02 16.6 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.431 0.53 . . . . 2.61 112.431 -175.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.7 mp -81.87 -21.95 37.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.346 -0.388 . . . . 1.14 111.858 -172.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.56 35.31 20.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 2.74 110.658 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -157.93 118.79 3.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 1.12 110.128 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -68.15 -37.4 81.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.625 -0.716 . . . . 2.32 111.496 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.11 -50.12 62.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.236 -0.438 . . . . 2.01 111.294 -175.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.71 -33.1 74.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.171 0.51 . . . . 1.48 109.925 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.4 87.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.531 0.682 . . . . 1.03 110.115 178.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.483 ' O ' HG22 ' A' ' 220' ' ' VAL . 4.3 t-20 -69.68 -43.02 73.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.248 -0.887 . . . . 0.63 109.759 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.43 -37.8 84.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.566 -0.743 . . . . 2.45 111.215 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . 0.406 HD13 HD22 ' A' ' 209' ' ' LEU . 32.5 mt -72.71 -36.34 67.8 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.829 -0.348 . . . . 1.08 110.44 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . 0.429 ' HD2' ' HB2' ' A' ' 202' ' ' GLN . 64.4 ttt180 -57.25 -41.97 80.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.099 0.476 . . . . 1.49 110.358 175.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 216' ' ' ASN . 88.4 t -70.45 -48.71 58.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.666 -0.697 . . . . 1.13 109.968 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.28 -48.71 80.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.995 -1.002 . . . . 1.09 110.845 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.69 83.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.684 -0.689 . . . . 2.18 110.538 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.8 tttt -67.66 -33.89 75.85 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.705 -0.398 . . . . 1.0 110.798 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 28.3 mm-40 -74.58 -30.64 61.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 2.28 109.69 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.27 -41.35 85.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 0.99 109.411 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.465 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.0 t90 -65.11 -39.36 92.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.066 -0.97 . . . . 0.21 109.963 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.2 mmm180 -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.086 -0.506 . . . . 2.82 111.09 176.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.08 -4.62 36.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.148 0.499 . . . . 1.85 110.972 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 24.3 t -80.22 -14.46 58.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.493 -0.558 . . . . 1.67 109.493 176.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.717 -0.659 . . . . 2.18 110.048 177.631 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 113.239 0.829 . . . . 1.46 113.239 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 14.9 p -87.18 -31.45 5.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.238 -0.585 . . . . 1.03 111.125 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . 0.403 HG21 HD13 ' A' ' 209' ' ' LEU . 27.7 t -68.11 -21.37 26.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.498 0.666 . . . . 1.07 110.381 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.453 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.52 11.67 12.11 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.907 -0.588 . . . . 0.9 111.373 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 45.1 p -106.34 145.88 31.12 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.245 0.545 . . . . 1.06 110.019 -175.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.71 -32.3 73.78 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.136 -0.938 . . . . 2.46 109.678 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.93 84.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.349 -0.841 . . . . 1.07 111.578 176.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.73 -50.75 69.87 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.902 -0.407 . . . . 0.31 109.902 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.12 -29.4 67.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.634 -0.712 . . . . 0.18 111.662 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -66.14 -48.52 70.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.04 0.448 . . . . 1.25 110.336 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -72.51 -32.57 66.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.226 -0.443 . . . . 1.37 110.95 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.51 -47.15 85.09 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.108 -0.701 . . . . 1.03 109.108 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.444 ' HB2' ' HD2' ' B' ' 219' ' ' ARG . 50.0 tt0 -65.93 -34.03 77.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.76 110.322 176.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.476 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -61.06 -40.37 98.42 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.827 -0.701 . . . . 0.18 112.051 176.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -66.0 -38.61 88.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.646 0.736 . . . . 2.18 109.2 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 2.9 mp -65.58 -33.57 76.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.936 -1.029 . . . . 1.07 110.719 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.93 -44.23 85.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.837 0.351 . . . . 1.14 110.411 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 50.2 mt-30 -59.48 -47.0 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.984 -0.553 . . . . 1.58 111.636 179.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.38 -47.11 16.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.289 0.478 . . . . 2.62 112.289 -175.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.7 mp -81.65 -21.94 37.85 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.845 0.313 . . . . 1.14 111.845 -172.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.28 35.6 20.78 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 124.098 0.874 . . . . 2.74 110.574 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -158.06 118.71 3.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 1.11 110.214 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -68.08 -37.54 81.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.665 -0.698 . . . . 2.31 111.525 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.94 -49.93 63.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.199 -0.455 . . . . 2.0 111.326 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -68.03 -33.13 74.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 1.48 109.965 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.39 87.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 1.04 110.095 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.477 ' O ' HG22 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.63 -43.14 73.3 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.372 -0.831 . . . . 0.63 109.792 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.38 -37.89 85.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.462 -0.79 . . . . 2.43 111.103 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . 0.403 HD13 HD22 ' B' ' 209' ' ' LEU . 32.4 mt -72.59 -36.53 68.17 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.772 -0.371 . . . . 1.08 110.348 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . 0.444 ' HD2' ' HB2' ' B' ' 202' ' ' GLN . 64.0 ttt180 -56.98 -42.08 79.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.064 0.459 . . . . 1.49 110.244 175.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.477 HG22 ' O ' ' B' ' 216' ' ' ASN . 80.1 t -70.48 -48.61 58.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 1.12 109.946 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.7 tp -59.46 -48.53 81.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.956 -1.02 . . . . 1.09 110.817 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.87 84.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.643 -0.708 . . . . 2.18 110.646 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.8 tttt -67.45 -34.12 76.55 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.799 -0.361 . . . . 1.0 110.79 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 28.4 mm-40 -74.61 -30.55 61.72 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.223 0.535 . . . . 2.27 109.728 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.19 -41.26 86.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.483 -0.781 . . . . 0.98 109.452 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.453 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.6 t90 -65.14 -39.33 92.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.02 -0.991 . . . . 0.2 109.984 177.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.3 mmm180 -64.6 -40.16 95.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 2.82 111.075 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.2 t -74.06 -4.94 38.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.046 0.45 . . . . 1.85 110.905 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.4 t -79.76 -14.85 58.42 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.65 -0.5 . . . . 1.68 109.65 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.625 -0.702 . . . . 2.17 110.094 177.655 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 CA--C 1.529 0.171 0 N-CA-C 112.497 0.554 . . . . 1.47 112.497 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' B' ' 209' ' ' LEU . 7.5 p -75.29 -30.35 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 1.03 110.812 -179.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 40.4 t -69.6 -20.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.565 0.698 . . . . 1.08 109.701 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.441 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.33 10.95 13.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.574 -0.739 . . . . 0.9 111.404 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 40.1 p -106.56 144.47 33.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.211 0.529 . . . . 1.07 110.005 -175.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.93 -31.23 72.03 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.278 -0.874 . . . . 2.46 109.429 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.65 89.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.106 -0.952 . . . . 1.07 111.247 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -61.71 -48.44 80.74 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.938 0.399 . . . . 0.31 109.971 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.78 -28.67 66.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.572 -0.74 . . . . 0.19 111.664 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -66.37 -48.99 68.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.834 0.349 . . . . 1.23 110.358 174.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.36 -37.91 86.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.05 0.452 . . . . 1.37 110.682 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.18 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.585 -0.734 . . . . 1.03 109.735 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.444 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 60.9 tt0 -64.2 -36.75 85.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.025 -0.534 . . . . 0.75 110.387 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.517 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.0 -41.79 98.07 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.034 -0.603 . . . . 0.18 112.069 177.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -66.56 -39.07 88.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.172 0.51 . . . . 2.18 109.637 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.5 mp -64.98 -34.15 77.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.565 -0.743 . . . . 1.07 110.539 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 47.3 mt-10 -65.97 -43.98 86.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.674 0.274 . . . . 1.13 110.488 176.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.517 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 46.3 mt-30 -62.85 -48.81 77.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.433 . . . . 1.58 111.691 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.8 tpt85 -77.87 -43.61 29.66 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.989 -0.551 . . . . 2.61 111.531 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.606 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 3.1 mp -84.25 -23.29 30.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.243 -0.435 . . . . 1.14 112.16 -176.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.37 36.27 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.84 0.713 . . . . 2.74 111.133 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -156.88 117.09 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.994 -0.548 . . . . 1.12 110.266 -177.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -67.79 -37.19 81.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.684 -0.689 . . . . 2.32 111.355 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -62.58 -50.18 72.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.318 -0.401 . . . . 2.01 110.917 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.49 -37.62 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.972 -0.558 . . . . 1.48 110.005 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.11 -41.65 90.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.82 -0.627 . . . . 1.03 110.618 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.409 ' O ' HG23 ' A' ' 220' ' ' VAL . 0.2 OUTLIER -70.87 -41.94 70.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.597 -0.728 . . . . 0.63 110.253 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -59.95 -43.07 95.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.013 -0.54 . . . . 2.45 110.684 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 63.1 mt -72.91 -34.86 66.88 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.744 -0.662 . . . . 1.08 110.196 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -57.42 -44.32 84.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.134 0.492 . . . . 1.49 110.036 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 216' ' ' ASN . 73.4 t -71.68 -49.23 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.674 -0.694 . . . . 1.13 110.28 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.69 -48.68 80.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.028 -0.987 . . . . 1.09 110.783 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -65.23 -38.85 91.69 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.649 -0.705 . . . . 2.18 110.585 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.3 tttt -65.75 -33.84 76.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.841 -0.343 . . . . 1.0 110.866 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -76.97 -29.33 55.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.944 0.402 . . . . 2.28 110.248 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.74 87.25 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.767 -0.652 . . . . 0.99 109.358 173.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.441 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.7 t90 -63.61 -37.1 86.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.061 -0.972 . . . . 0.21 109.965 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 37.1 mmt180 -62.34 -37.85 87.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.157 -0.474 . . . . 2.82 110.686 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 18.4 t -75.23 -10.05 59.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.308 -0.406 . . . . 1.85 110.962 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.2 t -76.61 -7.35 55.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.037 0.446 . . . . 1.67 109.89 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.708 -0.663 . . . . 2.18 109.894 175.867 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.462 0.139 0 N-CA-C 112.409 0.522 . . . . 1.46 112.409 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' A' ' 209' ' ' LEU . 7.5 p -74.95 -30.68 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.794 0.331 . . . . 1.03 110.868 -178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.48 -20.79 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.681 0.753 . . . . 1.07 109.74 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.446 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.04 10.9 12.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.42 -0.809 . . . . 0.9 111.551 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 41.5 p -106.75 144.3 33.6 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.216 0.531 . . . . 1.06 109.968 -175.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -65.86 -31.33 72.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.253 -0.885 . . . . 2.46 109.373 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.72 89.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.121 -0.945 . . . . 1.07 111.356 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -61.63 -48.48 80.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.941 -0.392 . . . . 0.31 109.941 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.67 -28.59 67.01 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.666 -0.697 . . . . 0.18 111.707 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.44 -48.99 68.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.72 0.295 . . . . 1.25 110.385 174.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -66.31 -37.97 86.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.966 0.412 . . . . 1.37 110.737 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.2 -47.0 86.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 1.03 109.646 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.446 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 61.1 tt0 -63.85 -36.95 85.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.76 110.459 177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.502 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.18 -41.74 98.32 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.104 -0.569 . . . . 0.18 111.996 177.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -66.48 -39.11 88.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.62 -0.511 . . . . 2.18 109.62 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.4 mp -64.96 -34.1 77.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.623 -0.717 . . . . 1.07 110.434 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 45.2 mt-10 -66.22 -43.49 86.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.734 0.302 . . . . 1.14 110.499 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 46.7 mt-30 -63.22 -48.92 76.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.019 0.437 . . . . 1.58 111.808 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 3.9 tpt85 -77.81 -43.47 30.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.959 -0.564 . . . . 2.62 111.456 -173.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.606 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 2.9 mp -84.17 -23.51 30.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.227 -0.442 . . . . 1.14 112.187 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.54 35.97 26.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.582 -0.735 . . . . 2.74 111.131 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -156.5 117.41 3.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.005 -0.543 . . . . 1.11 110.238 -177.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -67.85 -37.42 81.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.766 -0.652 . . . . 2.31 111.367 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.45 -50.31 71.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 2.0 110.817 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.44 -37.37 87.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.084 -0.507 . . . . 1.48 109.957 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.32 -41.59 89.43 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.887 -0.597 . . . . 1.04 110.644 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.407 ' O ' HG23 ' B' ' 220' ' ' VAL . 0.2 OUTLIER -70.77 -42.28 70.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.665 -0.698 . . . . 0.63 110.184 -179.402 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -59.71 -43.07 94.27 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.948 -0.569 . . . . 2.43 110.67 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 63.3 mt -72.94 -34.75 66.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.85 -0.614 . . . . 1.08 110.241 -178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -57.66 -44.28 85.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.06 0.457 . . . . 1.49 110.06 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 216' ' ' ASN . 66.7 t -71.54 -49.45 46.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.749 -0.659 . . . . 1.12 110.277 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.9 tp -58.3 -48.7 79.67 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.002 -0.999 . . . . 1.09 110.981 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -65.13 -38.93 92.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.668 -0.696 . . . . 2.18 110.577 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.2 tttt -65.56 -34.08 77.42 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.926 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -76.92 -29.33 55.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.09 0.471 . . . . 2.27 110.096 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.47 -42.65 87.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.29 -0.633 . . . . 0.98 109.29 173.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.446 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 52.6 t90 -63.62 -37.08 85.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.995 -1.002 . . . . 0.2 110.017 176.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 37.0 mmt180 -62.37 -37.63 86.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 2.82 110.859 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.9 t -75.58 -9.95 59.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 1.85 110.788 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 19.4 t -76.46 -7.84 55.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.172 0.51 . . . . 1.68 110.054 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.652 -0.689 . . . . 2.17 109.849 175.893 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.458 -0.071 0 N-CA-C 112.102 0.408 . . . . 1.47 112.102 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.06 -32.85 52.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.773 -0.371 . . . . 1.03 110.939 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 22.1 t -66.97 -19.85 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.69 0.757 . . . . 1.08 109.749 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.469 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -90.04 12.2 18.41 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.613 -0.721 . . . . 0.9 111.597 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 42.8 p -107.86 152.18 24.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.227 0.536 . . . . 1.07 110.362 -176.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.51 -32.69 74.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.385 -0.825 . . . . 2.46 109.708 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.61 90.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.23 -0.896 . . . . 1.07 111.863 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -62.35 -50.94 69.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.31 110.236 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -69.18 -28.27 66.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.705 -0.679 . . . . 0.19 111.448 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.66 -51.98 65.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 1.23 110.509 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.65 -32.5 65.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.275 -0.42 . . . . 1.37 111.371 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.86 -47.78 83.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.166 -0.679 . . . . 1.03 109.166 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.2 tt0 -67.0 -33.18 75.0 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.925 -0.58 . . . . 0.75 110.195 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.447 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.77 -40.12 97.7 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.928 -0.653 . . . . 0.18 111.906 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -67.16 -38.73 85.98 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.528 -0.545 . . . . 2.18 109.528 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.7 mp -66.19 -38.19 87.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.529 -0.76 . . . . 1.07 110.561 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.7 mt-10 -63.36 -48.54 77.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.362 . . . . 1.13 110.863 176.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 95.9 mt-30 -66.24 -40.94 90.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.357 -0.383 . . . . 1.58 112.011 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -77.75 -48.47 16.57 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.814 0.301 . . . . 2.61 111.814 -177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.1 mp -82.31 -23.34 35.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 1.14 111.784 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . 0.409 ' HE3' ' O ' ' A' ' 207' ' ' GLN . 33.9 mmtp 58.76 39.82 23.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.274 -0.875 . . . . 2.74 110.487 -174.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -153.1 109.4 3.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.572 -0.74 . . . . 1.12 109.812 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -67.61 -36.43 80.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.279 -0.419 . . . . 2.32 111.497 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -64.05 -50.4 68.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.871 0.367 . . . . 2.01 110.712 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.67 -29.86 66.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.095 -0.502 . . . . 1.48 110.29 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.35 85.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.547 0.689 . . . . 1.03 109.752 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.405 ' O ' HG22 ' A' ' 220' ' ' VAL . 3.2 t-20 -70.1 -46.25 65.25 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.066 -0.97 . . . . 0.63 110.318 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -59.07 -40.72 86.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 2.45 110.899 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.63 -36.89 68.14 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.003 -0.544 . . . . 1.08 110.38 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -58.94 -42.55 90.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.926 0.393 . . . . 1.49 110.388 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 216' ' ' ASN . 88.9 t -71.13 -44.63 74.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.924 -0.58 . . . . 1.13 109.707 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.0 tp -57.24 -50.86 71.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.891 -1.049 . . . . 1.09 110.89 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.75 -37.14 81.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.212 -0.904 . . . . 2.18 110.591 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.6 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.7 tttt -66.09 -36.38 83.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.537 -0.301 . . . . 1.0 110.68 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.192 0.52 . . . . 2.28 110.042 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.17 -40.57 86.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.493 -0.776 . . . . 0.99 109.346 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.469 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 47.5 t90 -67.35 -39.81 85.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.063 -0.971 . . . . 0.21 110.366 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.6 mmm180 -61.32 -39.06 89.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.966 0.412 . . . . 2.82 110.467 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.06 -6.21 46.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 1.85 111.131 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 65.8 m -84.52 -9.59 58.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.989 0.423 . . . . 1.67 110.667 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.289 -0.862 . . . . 2.18 110.184 176.074 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.23 0.056 0 N-CA-C 111.959 0.355 . . . . 1.46 111.959 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 12.1 p -70.18 -32.95 52.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 C-N-CA 120.961 -0.296 . . . . 1.03 110.883 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 22.4 t -66.95 -19.88 26.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.619 0.723 . . . . 1.07 109.747 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.473 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -90.1 12.37 17.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.613 -0.721 . . . . 0.9 111.432 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.99 152.12 24.9 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.376 0.607 . . . . 1.06 110.355 -176.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.4 -32.65 74.16 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.295 -0.866 . . . . 2.46 109.826 176.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.75 90.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.331 -0.85 . . . . 1.07 111.856 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -62.16 -51.08 69.28 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.31 110.196 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -69.1 -28.13 66.21 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.621 -0.718 . . . . 0.18 111.536 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.64 -51.96 65.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.851 0.358 . . . . 1.25 110.487 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.68 -32.52 65.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 1.37 111.386 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.13 -47.58 84.76 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.194 -0.669 . . . . 1.03 109.194 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.0 tt0 -66.99 -33.31 75.3 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.76 110.252 176.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.75 -40.13 97.69 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 121.076 -0.583 . . . . 0.18 112.007 176.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -67.01 -38.73 86.47 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.566 -0.531 . . . . 2.18 109.566 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.6 mp -66.08 -38.38 88.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.433 -0.803 . . . . 1.07 110.528 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.8 mt-10 -63.24 -48.81 76.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.841 0.353 . . . . 1.14 110.801 176.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 95.8 mt-30 -66.09 -40.93 91.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.196 -0.456 . . . . 1.58 111.971 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -77.8 -48.53 16.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.753 0.311 . . . . 2.62 111.731 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.1 mp -82.38 -23.12 35.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.815 0.302 . . . . 1.14 111.815 -175.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' B' ' 207' ' ' GLN . 33.9 mmtp 58.47 39.8 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.393 -0.822 . . . . 2.74 110.484 -174.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.05 109.72 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.507 -0.769 . . . . 1.11 109.736 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -67.55 -36.28 80.66 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.275 -0.421 . . . . 2.31 111.49 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.33 -50.19 68.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.86 0.362 . . . . 2.0 110.804 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.78 -29.88 66.2 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.126 -0.488 . . . . 1.48 110.113 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.23 85.63 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.516 0.674 . . . . 1.04 109.641 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.411 ' O ' HG22 ' B' ' 220' ' ' VAL . 3.3 t-20 -70.22 -46.63 64.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.14 -0.936 . . . . 0.63 110.27 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -58.65 -40.79 84.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 2.43 110.912 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.71 -36.61 67.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.002 -0.544 . . . . 1.08 110.364 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -59.04 -42.63 90.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.898 0.38 . . . . 1.49 110.367 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.411 HG22 ' O ' ' B' ' 216' ' ' ASN . 84.6 t -71.23 -44.6 73.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.42 0.628 . . . . 1.12 109.678 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.12 -50.73 71.89 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.945 -1.025 . . . . 1.09 110.915 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.99 -37.34 81.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 2.18 110.609 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.601 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.7 tttt -65.87 -36.38 83.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.505 -0.316 . . . . 1.0 110.716 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.21 -31.64 64.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.133 0.492 . . . . 2.27 109.921 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.62 86.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.98 109.341 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.473 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 47.1 t90 -67.49 -39.57 85.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.029 -0.987 . . . . 0.2 110.283 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.2 mmm180 -61.29 -39.34 90.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 2.82 110.423 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.31 -5.56 42.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 1.85 111.167 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 59.6 m -84.84 -9.81 57.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.045 0.45 . . . . 1.68 110.64 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.579 -0.724 . . . . 2.17 110.189 175.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 111.895 0.331 . . . . 1.47 111.895 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.463 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 9.5 p -79.56 -25.8 12.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 C-N-CA 120.231 -0.587 . . . . 1.03 110.034 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.4 ' HA ' ' CG ' ' A' ' 197' ' ' PHE . 51.2 t -69.05 -25.0 28.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.411 0.625 . . . . 1.08 109.815 176.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.465 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -82.64 12.05 5.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.726 -0.67 . . . . 0.9 111.842 -177.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.03 153.01 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.918 0.389 . . . . 1.07 110.487 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.97 -34.77 78.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.866 -0.606 . . . . 2.46 109.747 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.26 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.453 -0.794 . . . . 1.07 111.829 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 59.3 t80 -61.9 -51.13 69.41 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.824 0.345 . . . . 0.31 110.099 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . 0.413 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 97.2 m95 -69.02 -28.38 66.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.496 -0.775 . . . . 0.19 111.54 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.17 -49.77 70.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.279 -0.418 . . . . 1.23 110.408 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.01 -33.7 70.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 1.37 110.904 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . 0.411 ' O ' HD11 ' A' ' 205' ' ' LEU . 1.7 tm? -59.49 -47.63 84.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.378 -0.601 . . . . 1.03 109.378 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.5 tt0 -66.47 -33.47 75.76 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.089 -0.505 . . . . 0.75 110.272 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.8 -41.28 99.08 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 121.049 -0.596 . . . . 0.18 111.929 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -66.95 -38.4 86.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 2.18 109.784 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.8 mp -65.22 -37.76 88.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.582 -0.735 . . . . 1.07 110.475 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 49.7 mt-10 -65.9 -45.41 82.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.567 -0.288 . . . . 1.13 110.828 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.0 mt-30 -61.97 -48.29 81.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.931 0.396 . . . . 1.58 111.459 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -72.75 -48.31 39.57 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.941 -0.572 . . . . 2.61 111.383 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 6.6 mp -83.13 -23.12 33.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.079 -0.509 . . . . 1.14 111.352 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.56 39.97 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.222 -0.899 . . . . 2.74 109.928 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.85 113.75 3.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.624 -0.716 . . . . 1.12 110.434 -176.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -67.87 -33.85 75.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.853 -0.612 . . . . 2.32 111.244 -177.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.67 -51.11 61.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.449 . . . . 2.01 111.026 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -68.82 -35.09 76.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 1.48 109.988 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.82 -39.34 87.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.738 -0.664 . . . . 1.03 110.486 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.441 ' O ' HG21 ' A' ' 220' ' ' VAL . 3.1 t-20 -66.98 -48.31 68.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.57 -0.741 . . . . 0.63 110.311 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.99 -39.22 77.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.88 -0.6 . . . . 2.45 111.027 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 42.7 mt -72.66 -39.43 67.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.138 -0.483 . . . . 1.08 110.9 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.26 -41.02 87.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.059 0.457 . . . . 1.49 110.179 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 87.3 t -70.24 -44.69 77.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.689 -0.687 . . . . 1.13 109.66 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.0 -49.89 76.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.98 -1.009 . . . . 1.09 110.624 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -68.1 -38.56 82.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.329 -0.85 . . . . 2.18 110.852 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.8 tttt -67.11 -36.16 81.34 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.823 -0.351 . . . . 1.0 110.821 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 47.3 mm-40 -75.38 -28.9 59.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.04 0.447 . . . . 2.28 110.024 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.2 -40.04 82.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.65 -0.705 . . . . 0.99 109.301 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.465 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 51.5 t90 -64.7 -40.21 94.98 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.917 -1.038 . . . . 0.21 109.851 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.8 mmm180 -62.97 -39.99 96.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.997 -0.547 . . . . 2.82 110.661 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 25.9 t -73.48 -6.1 44.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 1.85 111.116 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.0 t -79.28 -13.56 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.154 0.502 . . . . 1.67 109.756 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.576 -0.726 . . . . 2.18 110.01 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 111.931 0.345 . . . . 1.46 111.931 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . 0.469 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 9.4 p -79.58 -25.71 12.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 120.262 -0.575 . . . . 1.03 109.96 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 51.5 t -69.09 -25.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.423 0.63 . . . . 1.07 109.8 176.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -82.38 11.82 5.12 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.763 -0.653 . . . . 0.9 111.949 -177.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.01 153.07 23.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.967 0.413 . . . . 1.06 110.49 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.0 -34.59 78.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.756 -0.656 . . . . 2.46 109.823 176.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.79 84.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.343 -0.844 . . . . 1.07 111.828 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -61.81 -51.14 69.49 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.31 110.134 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . 0.422 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 97.2 m95 -69.17 -28.31 66.29 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.511 -0.768 . . . . 0.18 111.453 -178.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.11 -49.8 70.79 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.232 -0.44 . . . . 1.25 110.473 174.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.12 -33.75 70.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 1.37 110.864 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . 0.408 ' O ' HD11 ' B' ' 205' ' ' LEU . 1.8 tm? -59.23 -47.88 83.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.326 -0.62 . . . . 1.03 109.326 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.421 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.4 tt0 -66.25 -33.63 76.18 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.969 -0.56 . . . . 0.76 110.349 176.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.67 -41.07 98.79 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.057 -0.592 . . . . 0.18 111.873 176.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -67.32 -38.37 84.82 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.668 -0.493 . . . . 2.18 109.668 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.9 mp -65.13 -37.69 88.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.755 . . . . 1.07 110.55 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 49.3 mt-10 -65.77 -45.82 81.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.589 -0.278 . . . . 1.14 110.873 177.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 52.9 mt-30 -61.74 -48.27 81.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 1.58 111.375 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' B' ' 208' ' ' ARG . 4.4 tpt180 -72.66 -48.18 41.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.81 -0.632 . . . . 2.62 111.482 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.6 mp -83.43 -23.02 32.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.05 -0.523 . . . . 1.14 111.496 -176.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.67 39.62 30.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.254 -0.885 . . . . 2.74 109.928 -175.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.79 113.52 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.594 -0.73 . . . . 1.11 110.32 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -67.84 -33.71 75.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.792 -0.64 . . . . 2.31 111.22 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.8 -51.09 61.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.233 -0.44 . . . . 2.0 110.91 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.95 -35.09 76.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.858 -0.61 . . . . 1.48 109.957 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.31 87.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.759 -0.655 . . . . 1.04 110.45 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.442 ' O ' HG21 ' B' ' 220' ' ' VAL . 3.3 t-20 -66.93 -48.46 68.55 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.56 -0.745 . . . . 0.63 110.382 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.97 -39.04 77.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.917 -0.583 . . . . 2.43 111.011 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.82 -39.46 66.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.207 -0.451 . . . . 1.08 110.916 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.17 -41.15 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 1.49 110.236 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 90.1 t -70.24 -44.66 77.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.684 -0.689 . . . . 1.12 109.647 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 61.0 tp -59.06 -49.61 77.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.869 -1.059 . . . . 1.09 110.683 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -68.33 -38.35 81.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.428 -0.805 . . . . 2.18 110.869 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.9 tttt -67.2 -36.23 81.3 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.837 -0.345 . . . . 1.0 110.89 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 49.7 mm-40 -75.34 -28.74 59.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 2.27 110.056 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.94 81.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.639 -0.71 . . . . 0.98 109.313 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.3 t90 -64.8 -40.05 94.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.846 -1.07 . . . . 0.2 109.854 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.7 mmm180 -63.12 -40.08 96.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.867 -0.606 . . . . 2.82 110.693 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.6 t -73.38 -5.84 42.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.858 0.361 . . . . 1.85 111.108 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 20.9 t -79.35 -13.71 59.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.157 0.503 . . . . 1.68 109.847 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.245 0.832 0 CA-C-O 118.58 -0.724 . . . . 2.17 110.142 177.513 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.946 0.403 . . . . 1.47 110.818 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 14.4 p -76.36 -30.36 19.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 116.236 -0.438 . . . . 1.03 110.185 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.409 HG21 HD11 ' B' ' 209' ' ' LEU . 60.7 t -69.7 -23.68 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.545 0.688 . . . . 1.08 109.614 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.407 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.24 12.43 5.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.477 -0.783 . . . . 0.9 111.505 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.82 150.23 27.27 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.076 0.465 . . . . 1.07 110.494 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.41 -34.14 77.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.417 -0.811 . . . . 2.46 109.844 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.0 -35.33 78.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.165 -0.925 . . . . 1.07 111.809 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 58.9 t80 -63.87 -51.04 66.4 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.865 0.364 . . . . 0.31 110.123 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . 0.446 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 93.9 m95 -68.11 -29.89 68.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 0.19 111.255 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.9 -43.92 78.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.432 -0.349 . . . . 1.23 110.338 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -71.7 -35.85 70.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.212 0.53 . . . . 1.37 109.75 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.65 -47.73 83.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.426 -0.806 . . . . 1.03 109.348 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.509 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.62 -28.68 67.95 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.196 -0.457 . . . . 0.75 110.204 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.27 -41.77 98.46 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.854 -0.689 . . . . 0.18 111.599 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -66.81 -38.24 86.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 2.18 109.87 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.1 mp -66.5 -40.03 89.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.754 -0.657 . . . . 1.07 110.698 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.13 -43.61 91.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.568 0.223 . . . . 1.13 110.939 177.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' A' ' 210' ' ' LYS . 49.4 mt-30 -60.8 -48.94 79.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.823 0.344 . . . . 1.58 111.707 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.24 -43.49 51.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.153 -0.476 . . . . 2.61 111.55 -173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.9 mp -88.28 -23.71 23.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.218 -0.446 . . . . 1.14 112.202 -174.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' A' ' 207' ' ' GLN . 75.5 mmtt 55.09 38.61 30.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.868 -0.605 . . . . 2.74 110.679 -175.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -150.03 110.68 4.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 1.12 109.351 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -65.29 -38.98 91.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.133 -0.485 . . . . 2.32 111.46 -175.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.37 -50.42 69.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.264 -0.425 . . . . 2.01 111.02 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.23 -35.1 75.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.002 0.43 . . . . 1.48 110.461 -177.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.47 89.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.359 0.6 . . . . 1.03 110.203 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.45 ' O ' HG22 ' A' ' 220' ' ' VAL . 2.7 t-20 -70.19 -45.38 66.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.164 -0.925 . . . . 0.63 109.904 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -58.0 -40.44 80.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.645 -0.707 . . . . 2.45 111.134 177.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.47 -37.51 68.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.16 -0.473 . . . . 1.08 110.455 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 48.4 ttp180 -56.36 -41.44 76.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.103 0.478 . . . . 1.49 110.155 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.61 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 89.2 t -70.57 -49.1 54.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.509 -0.768 . . . . 1.13 109.901 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.76 -48.74 78.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.867 -1.061 . . . . 1.09 110.829 -177.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -66.27 -38.32 87.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.61 -0.723 . . . . 2.18 110.524 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.2 tttt -64.4 -36.9 85.67 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.826 -0.35 . . . . 1.0 110.81 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.61 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 51.9 mt-10 -73.96 -30.59 62.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 2.28 109.735 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.5 -43.51 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.511 -0.768 . . . . 0.99 109.658 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.407 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 57.0 t90 -64.69 -39.96 94.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.21 110.08 177.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.8 mmm180 -63.21 -39.23 94.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 2.82 111.088 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 22.0 m -73.98 -5.01 38.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.499 -0.319 . . . . 1.85 111.446 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 27.4 t -79.66 -11.53 59.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.281 0.562 . . . . 1.67 109.749 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.435 -0.793 . . . . 2.18 110.205 178.231 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.911 0.386 . . . . 1.46 110.746 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 14.5 p -76.12 -30.16 20.15 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.372 -0.376 . . . . 1.03 110.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . 0.427 HG21 HD11 ' A' ' 209' ' ' LEU . 60.5 t -69.82 -23.45 25.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.541 0.686 . . . . 1.07 109.585 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.409 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 12.25 5.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.543 -0.753 . . . . 0.9 111.516 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 42.1 p -107.58 150.18 27.16 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.191 0.519 . . . . 1.06 110.446 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.41 -34.21 77.76 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.358 -0.837 . . . . 2.46 109.777 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.29 78.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.267 -0.878 . . . . 1.07 111.798 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -63.79 -50.86 67.33 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 120.914 0.388 . . . . 0.31 110.207 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . 0.451 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 94.0 m95 -68.39 -29.86 68.65 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.756 -0.657 . . . . 0.18 111.238 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -67.81 -43.6 79.26 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.836 0.35 . . . . 1.25 110.557 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.0 -35.76 69.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.326 0.584 . . . . 1.37 109.84 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.7 -47.71 83.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 1.03 109.31 175.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.497 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.61 -28.81 68.06 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 116.157 -0.474 . . . . 0.76 110.24 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.21 -41.63 98.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.793 -0.718 . . . . 0.18 111.623 174.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -66.9 -38.07 85.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.004 0.43 . . . . 2.18 109.856 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.444 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.2 mp -66.77 -40.01 88.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.724 -0.671 . . . . 1.07 110.623 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.96 -43.73 91.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.805 -0.18 . . . . 1.14 110.896 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' B' ' 210' ' ' LYS . 49.2 mt-30 -61.25 -48.08 83.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 1.58 111.882 177.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.62 -43.64 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.21 -0.45 . . . . 2.62 111.476 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.1 mp -88.2 -23.88 23.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.065 -0.516 . . . . 1.14 112.085 -174.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' B' ' 207' ' ' GLN . 75.4 mmtt 55.4 38.31 30.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.753 -0.658 . . . . 2.74 110.689 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -149.64 110.76 4.38 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.701 -0.682 . . . . 1.11 109.476 -176.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -64.98 -39.13 93.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 2.31 111.611 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -63.33 -50.5 69.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.388 -0.369 . . . . 2.0 111.089 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -69.3 -35.1 75.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 1.48 110.362 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.04 -39.56 90.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.429 0.633 . . . . 1.04 110.209 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 220' ' ' VAL . 2.7 t-20 -70.26 -45.37 66.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.181 -0.918 . . . . 0.63 109.929 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -58.0 -40.48 80.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 2.43 111.059 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 57.9 mt -72.4 -37.54 68.65 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.165 -0.47 . . . . 1.08 110.519 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 48.3 ttp180 -56.43 -41.33 76.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 1.49 110.221 175.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 93.5 t -70.57 -49.11 54.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.548 -0.751 . . . . 1.12 109.866 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.07 -48.6 79.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.849 -1.069 . . . . 1.09 110.793 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -66.23 -38.22 87.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.632 -0.713 . . . . 2.18 110.552 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.1 tttt -64.59 -36.73 85.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.835 -0.346 . . . . 1.0 110.783 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 54.1 mt-10 -74.13 -30.57 62.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.611 -0.514 . . . . 2.27 109.611 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.46 -43.72 84.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.621 -0.718 . . . . 0.98 109.67 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.409 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 57.2 t90 -64.64 -39.76 94.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.323 -0.853 . . . . 0.2 110.096 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.9 mmm180 -63.58 -39.13 93.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 2.82 110.985 177.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.2 m -74.07 -4.57 36.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.556 -0.293 . . . . 1.85 111.353 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 25.1 t -79.89 -11.78 59.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 1.68 109.78 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.49 -0.767 . . . . 2.17 110.134 178.185 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.532 0.252 0 N-CA-C 112.618 0.599 . . . . 1.47 112.618 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.65 -28.03 12.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.321 -0.552 . . . . 1.03 110.491 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.407 HG22 HD12 ' B' ' 209' ' ' LEU . 40.7 t -68.5 -23.26 27.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.506 0.67 . . . . 1.08 109.912 177.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.454 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.61 12.28 6.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.725 -0.671 . . . . 0.9 111.658 -178.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 48.4 p -106.9 145.67 31.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.246 0.546 . . . . 1.07 110.108 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.13 -32.15 73.7 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.38 -0.827 . . . . 2.46 109.776 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.63 -36.47 82.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.736 -0.665 . . . . 1.07 111.564 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -61.8 -50.9 70.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.016 0.436 . . . . 0.31 109.959 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -69.07 -28.58 66.66 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.19 111.463 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.56 -49.39 71.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 1.23 110.281 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -72.68 -33.58 66.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.247 -0.433 . . . . 1.37 111.137 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.96 -47.53 84.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.229 -0.656 . . . . 1.03 109.229 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.483 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 55.7 tt0 -65.94 -35.54 80.89 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.954 -0.566 . . . . 0.75 110.302 175.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -58.74 -41.96 96.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.033 -0.603 . . . . 0.18 112.017 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -67.44 -38.12 84.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.456 -0.572 . . . . 2.18 109.456 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.5 mp -65.91 -35.44 80.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.394 -0.821 . . . . 1.07 110.68 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.9 mt-10 -64.53 -48.89 73.42 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.94 0.4 . . . . 1.13 110.48 177.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 48.4 mt-30 -65.44 -41.83 93.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.908 -0.587 . . . . 1.58 111.622 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.64 -50.78 16.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.176 -0.465 . . . . 2.61 111.447 -177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.0 mp -78.16 -22.11 49.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 1.14 112.071 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.57 16.12 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.899 0.749 . . . . 2.74 110.464 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.4 118.97 3.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.237 -0.438 . . . . 1.12 110.384 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -68.7 -37.78 79.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.771 -0.649 . . . . 2.32 111.609 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.82 -49.66 71.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.401 -0.363 . . . . 2.01 111.096 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.62 -31.09 70.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.198 0.523 . . . . 1.48 110.04 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.26 84.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 1.03 110.029 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.8 t-20 -69.2 -44.51 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.516 -0.765 . . . . 0.63 109.978 177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.18 -41.51 84.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.851 -0.613 . . . . 2.45 110.887 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 40.8 mt -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.105 -0.498 . . . . 1.08 110.731 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -59.96 -43.67 94.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.023 0.44 . . . . 1.49 110.184 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.607 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 64.5 t -70.48 -46.7 69.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.694 -0.685 . . . . 1.13 109.546 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.19 -49.07 78.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.02 -0.991 . . . . 1.09 110.728 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -67.72 -36.82 81.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.508 -0.769 . . . . 2.18 110.579 -178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.3 tttt -68.42 -33.86 74.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.638 0.256 . . . . 1.0 110.96 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 51.1 mm-40 -75.4 -29.25 59.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.326 0.584 . . . . 2.28 109.723 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.31 83.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.384 -0.825 . . . . 0.99 109.2 174.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.454 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -65.52 -38.59 90.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.957 -1.02 . . . . 0.21 109.892 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 40.4 mmt180 -58.98 -41.13 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 2.82 110.383 173.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 17.6 m -73.85 -10.0 59.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 1.85 111.49 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 15.9 t -74.59 -13.77 60.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.871 0.367 . . . . 1.67 110.613 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.655 -0.688 . . . . 2.18 110.154 178.593 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 112.502 0.556 . . . . 1.46 112.502 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -80.1 -27.82 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.388 -0.525 . . . . 1.03 110.536 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.48 -23.39 28.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.502 0.668 . . . . 1.07 110.003 177.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.46 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 11.96 6.32 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.596 -0.729 . . . . 0.9 111.555 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 47.5 p -106.34 145.79 31.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.168 0.508 . . . . 1.06 110.199 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.2 -32.15 73.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.457 -0.792 . . . . 2.46 109.751 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.23 82.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.682 -0.69 . . . . 1.07 111.625 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.91 -50.94 70.15 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.848 -0.427 . . . . 0.31 109.848 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -68.95 -28.79 66.96 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.39 -0.823 . . . . 0.18 111.557 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.48 -49.53 71.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.321 -0.4 . . . . 1.25 110.229 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.48 -33.63 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 1.37 111.189 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.95 -47.54 84.71 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.228 -0.656 . . . . 1.03 109.228 175.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.47 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 55.8 tt0 -65.91 -35.24 80.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.018 -0.537 . . . . 0.76 110.324 175.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.02 -42.01 96.73 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.046 -0.597 . . . . 0.18 112.168 177.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -67.35 -38.1 84.29 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.574 -0.528 . . . . 2.18 109.574 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.5 mp -65.94 -35.48 80.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.493 -0.776 . . . . 1.07 110.624 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.6 mt-10 -64.66 -48.68 73.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.794 0.33 . . . . 1.14 110.423 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 48.7 mt-30 -65.72 -41.65 92.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 1.58 111.564 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.59 -50.8 16.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.505 . . . . 2.62 111.431 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.0 mp -78.27 -22.19 48.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 1.14 112.089 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.64 16.09 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.907 0.755 . . . . 2.74 110.549 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.33 119.02 3.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 1.11 110.393 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -68.65 -37.64 79.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.831 -0.622 . . . . 2.31 111.557 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.0 -49.63 71.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.839 0.352 . . . . 2.0 111.035 -175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -68.83 -30.82 69.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.957 -0.565 . . . . 1.48 110.045 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.15 84.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.765 -0.652 . . . . 1.04 110.092 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.9 t-20 -69.17 -44.59 71.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.499 -0.773 . . . . 0.63 109.985 177.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.15 -41.31 83.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 2.43 111.001 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 40.1 mt -73.21 -36.62 66.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.063 -0.517 . . . . 1.08 110.682 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -60.0 -43.4 95.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.992 0.425 . . . . 1.49 110.218 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 62.0 t -70.6 -46.95 67.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 1.12 109.539 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.0 -48.87 78.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.924 -1.035 . . . . 1.09 110.855 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -67.82 -37.07 81.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.467 -0.788 . . . . 2.18 110.554 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.5 tttt -68.19 -34.24 75.93 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.068 -0.253 . . . . 1.0 110.936 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 52.3 mm-40 -75.25 -29.27 60.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.467 0.651 . . . . 2.27 109.675 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.94 -40.34 83.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.511 -0.768 . . . . 0.98 109.232 174.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.46 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.5 t90 -65.39 -38.58 90.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.019 -0.992 . . . . 0.2 109.933 177.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 40.5 mmt180 -58.99 -41.06 86.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 2.82 110.372 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.5 m -73.73 -10.12 59.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.077 -0.51 . . . . 1.85 111.501 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 16.8 t -74.75 -13.65 60.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.975 0.417 . . . . 1.68 110.512 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.687 -0.673 . . . . 2.17 110.358 178.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--O 1.228 -0.03 0 CA-C-O 120.774 0.321 . . . . 1.47 111.096 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 CA-C-N 116.359 -0.382 . . . . 1.03 110.856 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 19.4 t -69.22 -20.16 24.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.457 0.646 . . . . 1.08 110.018 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.418 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -89.0 11.63 17.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.898 -0.592 . . . . 0.9 111.458 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 49.1 p -106.51 158.56 16.83 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.601 -0.44 . . . . 1.07 110.764 -175.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.04 -39.14 89.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.863 -0.608 . . . . 2.46 109.615 175.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.97 -38.45 76.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.131 -0.94 . . . . 1.07 112.292 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.25 -51.31 66.71 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.749 -0.381 . . . . 0.31 110.348 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.09 -29.13 66.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.803 -0.635 . . . . 0.19 111.505 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -64.14 -52.02 61.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.135 -0.484 . . . . 1.23 110.413 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -71.61 -32.39 67.96 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 1.37 111.09 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.72 -46.75 86.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.171 -0.677 . . . . 1.03 109.171 175.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.27 -37.31 86.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.75 110.601 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.7 -39.52 95.35 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.938 -0.649 . . . . 0.18 112.142 176.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -66.14 -40.25 90.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.473 0.654 . . . . 2.18 109.294 177.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.9 mp -64.53 -34.28 77.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.07 -0.968 . . . . 1.07 110.487 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.66 -45.93 84.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.738 0.304 . . . . 1.13 110.419 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.6 mt-30 -58.93 -47.54 84.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 1.58 111.831 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.63 -45.41 17.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.236 -0.438 . . . . 2.61 112.136 -174.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.553 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.8 mp -82.16 -23.01 35.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 1.14 112.004 -172.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 56.81 37.24 28.67 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 123.969 0.793 . . . . 2.74 110.427 -176.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -156.47 110.3 2.71 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.566 -0.743 . . . . 1.12 109.8 -177.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.78 -34.16 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 2.32 111.222 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.27 -50.83 64.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.417 -0.356 . . . . 2.01 111.25 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.75 -27.95 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.422 . . . . 1.48 110.02 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.49 -37.21 84.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.493 0.663 . . . . 1.03 109.526 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.443 ' O ' HG21 ' A' ' 220' ' ' VAL . 2.8 t-20 -70.21 -46.63 64.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.274 -0.876 . . . . 0.63 110.121 178.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -58.27 -39.7 79.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.729 -0.669 . . . . 2.45 111.077 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . 0.457 HD12 HD21 ' A' ' 209' ' ' LEU . 33.5 mt -73.67 -36.29 65.31 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.183 -0.462 . . . . 1.08 110.653 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -57.66 -43.62 85.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.171 0.51 . . . . 1.49 110.007 177.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.591 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 58.8 t -71.38 -49.29 48.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.401 -0.818 . . . . 1.13 109.764 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . 0.491 HD21 ' O ' ' B' ' 225' ' ' ALA . 56.6 tp -57.14 -48.2 79.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.867 -1.06 . . . . 1.09 110.994 -177.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.39 -37.42 86.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.598 -0.728 . . . . 2.18 110.409 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.9 tttt -66.25 -33.64 76.21 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.836 -0.346 . . . . 1.0 110.726 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.71 64.7 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.521 -0.548 . . . . 2.28 109.521 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . 0.458 ' O ' HD21 ' B' ' 221' ' ' LEU . . . -68.29 -42.17 79.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.374 -0.83 . . . . 0.99 109.672 176.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.418 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -63.69 -39.03 93.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.276 -0.875 . . . . 0.21 110.131 177.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.6 mmm180 -64.12 -34.4 77.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.312 -0.403 . . . . 2.82 110.351 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -77.37 -7.35 55.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.526 -0.306 . . . . 1.85 111.032 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 32.4 t -75.21 -17.16 60.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.53 0.681 . . . . 1.67 109.563 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.413 -0.803 . . . . 2.18 109.684 176.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.581 0.229 . . . . 1.46 111.146 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.64 -36.37 77.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.368 -0.378 . . . . 1.03 110.816 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.98 -20.37 24.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.529 0.68 . . . . 1.07 110.002 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.429 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -89.05 11.54 18.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.876 -0.602 . . . . 0.9 111.52 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 50.1 p -106.52 158.65 16.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.93 0.395 . . . . 1.06 110.577 -175.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -65.97 -39.27 90.24 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.497 -0.557 . . . . 2.46 109.497 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.86 -38.65 76.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.157 -0.928 . . . . 1.07 112.36 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -63.33 -51.2 66.97 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.714 -0.394 . . . . 0.31 110.332 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -70.09 -29.07 65.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.926 -0.579 . . . . 0.18 111.502 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.21 -52.11 60.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.458 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -71.66 -32.28 67.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.138 -0.483 . . . . 1.37 111.018 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.7 -46.69 86.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.255 -0.646 . . . . 1.03 109.255 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.26 -37.19 86.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.856 -0.611 . . . . 0.76 110.618 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.0 -39.1 95.21 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.994 -0.622 . . . . 0.18 112.163 176.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -66.4 -40.26 89.52 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.535 0.683 . . . . 2.18 109.4 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.8 mp -64.68 -34.27 77.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.106 -0.952 . . . . 1.07 110.516 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.49 -46.24 83.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.772 0.32 . . . . 1.14 110.271 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 53.4 mt-30 -58.9 -47.37 85.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.554 . . . . 1.58 111.8 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.77 -45.4 17.06 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.163 0.431 . . . . 2.62 112.163 -174.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.7 mp -82.14 -22.97 35.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.259 -0.428 . . . . 1.14 112.045 -172.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.78 37.45 28.81 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.987 0.804 . . . . 2.74 110.398 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -156.71 109.92 2.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.472 -0.786 . . . . 1.11 109.845 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -67.53 -34.23 76.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.012 -0.54 . . . . 2.31 111.285 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.22 -50.93 63.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.51 -0.314 . . . . 2.0 111.098 -176.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -70.81 -27.76 64.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.019 0.438 . . . . 1.48 110.049 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.56 -37.26 84.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.583 0.706 . . . . 1.04 109.594 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.446 ' O ' HG21 ' B' ' 220' ' ' VAL . 2.9 t-20 -70.08 -46.86 64.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.185 -0.916 . . . . 0.63 110.124 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -57.85 -40.15 79.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.714 -0.676 . . . . 2.43 111.116 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . 0.463 HD12 HD21 ' B' ' 209' ' ' LEU . 32.9 mt -73.4 -36.3 66.0 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.179 -0.464 . . . . 1.08 110.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -57.73 -43.49 85.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.152 0.501 . . . . 1.49 110.06 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 60.5 t -71.43 -49.33 47.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.457 -0.792 . . . . 1.12 109.798 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . 0.458 HD21 ' O ' ' A' ' 225' ' ' ALA . 56.7 tp -56.98 -48.16 79.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.968 -1.014 . . . . 1.09 111.061 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.5 -37.56 87.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.581 -0.736 . . . . 2.18 110.235 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.0 tttt -65.99 -33.84 76.72 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.86 -0.336 . . . . 1.0 110.707 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.63 64.65 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.556 -0.535 . . . . 2.27 109.556 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . 0.491 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -68.38 -42.19 79.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.394 -0.821 . . . . 0.98 109.602 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.429 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.8 t90 -63.68 -38.93 92.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.285 -0.87 . . . . 0.2 110.249 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.5 mmm180 -64.24 -34.43 78.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 2.82 110.397 176.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.1 t -77.48 -6.86 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.444 -0.344 . . . . 1.85 111.147 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 31.6 t -75.52 -16.9 60.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.452 -0.573 . . . . 1.68 109.452 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.419 -0.801 . . . . 2.17 109.966 176.98 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 26.4 t . . . . . 0 C--O 1.23 0.062 0 N-CA-C 111.637 0.236 . . . . 1.47 111.637 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.6 -33.16 58.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.553 0.216 . . . . 1.03 111.122 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.421 HG11 ' CE2' ' A' ' 197' ' ' PHE . 44.0 t -69.14 -22.55 26.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.405 0.622 . . . . 1.08 110.183 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -86.16 12.36 9.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.837 -0.62 . . . . 0.9 111.756 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 36.9 p -108.43 155.32 20.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.013 0.435 . . . . 1.07 110.844 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -65.37 -32.97 74.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.75 -0.659 . . . . 2.46 109.262 174.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.01 -41.88 88.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.035 -0.984 . . . . 1.07 111.982 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . 0.438 ' CE1' HD13 ' B' ' 209' ' ' LEU . 54.2 t80 -64.3 -50.35 68.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.726 -0.39 . . . . 0.31 110.557 -179.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.1 -28.5 66.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.071 -0.513 . . . . 0.19 110.97 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -63.74 -49.7 72.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.998 -0.547 . . . . 1.23 110.433 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -70.94 -34.09 71.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.207 -0.452 . . . . 1.37 110.929 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . 0.412 ' O ' HD11 ' A' ' 205' ' ' LEU . 2.9 tm? -60.21 -48.04 83.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.957 -0.565 . . . . 1.03 109.739 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.437 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 47.1 tt0 -68.8 -34.7 75.96 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.677 -0.409 . . . . 0.75 110.364 176.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.09 95.41 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.18 111.773 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -67.62 -38.39 83.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.702 -0.481 . . . . 2.18 109.702 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 4.9 mp -66.03 -37.35 85.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.832 -0.622 . . . . 1.07 110.608 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -64.09 -47.36 80.35 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.713 0.292 . . . . 1.13 110.552 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -66.85 -43.23 84.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.177 -0.465 . . . . 1.58 111.77 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 8.7 tpt85 -75.15 -48.44 23.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.915 0.388 . . . . 2.61 111.308 -175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -77.24 -22.07 52.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.912 -0.585 . . . . 1.14 112.172 -176.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 63.11 32.46 15.21 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 124.131 0.895 . . . . 2.74 110.509 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.17 118.69 4.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 1.12 110.426 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -67.96 -40.06 83.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 2.32 112.085 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -62.2 -51.37 68.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.591 -0.277 . . . . 2.01 111.16 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.73 -28.26 64.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.358 -0.383 . . . . 1.48 110.462 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.58 -40.86 84.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.423 0.63 . . . . 1.03 109.975 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.419 ' O ' HG22 ' A' ' 220' ' ' VAL . 4.2 t-20 -69.05 -45.53 70.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.122 -0.944 . . . . 0.63 109.78 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.55 -40.49 87.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.364 -0.835 . . . . 2.45 111.149 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . 0.432 HD13 HD22 ' A' ' 209' ' ' LEU . 45.6 mt -72.77 -36.87 67.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.406 -0.361 . . . . 1.08 110.238 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . 0.437 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 40.6 ttp180 -56.43 -42.13 77.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.213 0.53 . . . . 1.49 110.172 175.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.586 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 99.5 t -71.33 -49.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.665 -0.698 . . . . 1.13 109.925 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 50.2 tp -56.63 -49.7 74.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.922 -1.036 . . . . 1.09 111.095 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -64.61 -36.93 85.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.224 -0.898 . . . . 2.18 110.491 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -68.57 -29.87 68.52 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.739 -0.384 . . . . 1.0 111.018 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.586 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 48.6 mt-10 -73.23 -33.78 65.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.311 -0.626 . . . . 2.28 109.311 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.82 -40.29 79.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.41 -0.813 . . . . 0.99 109.835 177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 58.1 t90 -65.13 -41.94 94.35 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.126 -0.943 . . . . 0.21 110.148 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -63.97 -37.98 89.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.043 -0.526 . . . . 2.82 111.089 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 43.4 m -73.71 -5.22 39.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.768 0.318 . . . . 1.85 111.641 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 64.0 m -85.75 -9.46 57.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.181 0.515 . . . . 1.67 110.412 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.685 -0.674 . . . . 2.18 109.748 176.901 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 25.9 t . . . . . 0 CA--C 1.528 0.105 0 CA-C-O 120.66 0.266 . . . . 1.46 111.632 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.53 -32.95 57.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.657 0.265 . . . . 1.03 111.092 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . 0.418 HG11 ' CE2' ' B' ' 197' ' ' PHE . 43.6 t -69.24 -22.64 26.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.264 0.554 . . . . 1.07 110.256 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.41 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.29 12.14 10.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.867 -0.606 . . . . 0.9 111.625 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 35.8 p -108.15 155.31 20.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.917 0.389 . . . . 1.06 110.753 -175.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.38 -32.99 74.92 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.238 -0.653 . . . . 2.46 109.238 174.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.98 88.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.141 -0.936 . . . . 1.07 111.83 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . 0.486 ' CE1' HD13 ' A' ' 209' ' ' LEU . 54.4 t80 -64.18 -50.43 68.15 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.658 -0.417 . . . . 0.31 110.565 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.13 -28.36 66.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.1 -0.5 . . . . 0.18 110.972 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -63.76 -49.86 71.34 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 1.25 110.481 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.84 -34.02 71.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.284 -0.417 . . . . 1.37 110.867 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . 0.416 ' O ' HD11 ' B' ' 205' ' ' LEU . 2.9 tm? -60.15 -48.01 83.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 1.03 109.726 177.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.464 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 47.3 tt0 -68.81 -35.09 76.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.407 -0.36 . . . . 0.76 110.399 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -57.95 -41.97 94.58 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.827 -0.701 . . . . 0.18 111.742 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.96 -38.04 82.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.722 -0.473 . . . . 2.18 109.722 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.541 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 4.9 mp -66.44 -37.17 84.58 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.862 -0.608 . . . . 1.07 110.652 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -63.96 -47.81 78.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.781 0.324 . . . . 1.14 110.532 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -66.43 -43.22 86.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 1.58 111.878 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -75.18 -48.45 23.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.831 0.348 . . . . 2.62 111.295 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.9 mp -77.34 -21.88 52.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.98 -0.555 . . . . 1.14 112.171 -176.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 62.85 32.48 15.8 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 124.135 0.897 . . . . 2.74 110.593 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -155.15 118.57 4.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 1.11 110.285 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.86 -40.07 83.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.953 -0.567 . . . . 2.31 112.069 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -62.23 -51.13 69.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.648 0.261 . . . . 2.0 111.191 -174.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.01 -28.17 64.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.886 0.374 . . . . 1.48 110.422 -177.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.54 -41.01 84.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.506 0.669 . . . . 1.04 109.958 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.418 ' O ' HG22 ' B' ' 220' ' ' VAL . 4.4 t-20 -69.13 -45.55 69.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.095 -0.957 . . . . 0.63 109.757 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.39 -40.42 86.54 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.404 -0.816 . . . . 2.43 111.245 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . 0.417 HD13 HD22 ' B' ' 209' ' ' LEU . 45.5 mt -72.79 -36.87 67.68 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.336 -0.393 . . . . 1.08 110.284 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . 0.464 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 40.8 ttp180 -56.46 -42.21 77.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.18 0.514 . . . . 1.49 110.125 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.578 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 97.2 t -71.28 -49.66 46.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.634 -0.712 . . . . 1.12 109.969 -178.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 50.0 tp -56.62 -49.43 75.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.908 -1.042 . . . . 1.09 111.115 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -64.8 -37.3 87.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.201 -0.909 . . . . 2.18 110.324 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -68.3 -30.06 68.96 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.758 -0.377 . . . . 1.0 110.908 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 48.3 mt-10 -73.22 -33.24 65.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.415 -0.587 . . . . 2.27 109.415 178.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.17 77.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.399 -0.818 . . . . 0.98 109.701 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.41 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 58.4 t90 -65.32 -41.85 93.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.06 -0.973 . . . . 0.2 110.187 177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -64.13 -37.81 88.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.53 . . . . 2.82 111.146 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 43.8 m -73.99 -4.74 37.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.508 -0.314 . . . . 1.85 111.693 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 66.3 m -85.88 -9.79 56.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.118 0.485 . . . . 1.68 110.426 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.553 -0.737 . . . . 2.17 109.917 177.05 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.468 0.175 . . . . 1.47 110.65 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.0 p -70.59 -33.92 55.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-O 120.82 0.343 . . . . 1.03 110.78 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' VAL . . . . . 0.44 HG11 ' CE2' ' A' ' 197' ' ' PHE . 39.0 t -71.48 -19.75 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.704 0.764 . . . . 1.08 109.679 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' ALA . . . . . 0.475 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.14 11.59 11.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.468 -0.787 . . . . 0.9 111.466 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.9 p -106.02 151.22 24.92 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.049 0.452 . . . . 1.07 110.193 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -65.76 -32.9 74.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.7 -0.682 . . . . 2.46 109.304 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.55 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.925 -1.034 . . . . 1.07 111.782 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' PHE . . . . . 0.44 ' CE2' HG11 ' A' ' 192' ' ' VAL . 57.1 t80 -62.22 -50.23 72.59 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.737 0.303 . . . . 0.31 110.244 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -68.75 -28.86 67.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.785 -0.643 . . . . 0.19 111.51 -177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.94 -47.82 73.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.68 0.276 . . . . 1.23 110.386 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -66.64 -37.44 84.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.956 0.407 . . . . 1.37 110.598 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.89 -47.69 84.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.757 . . . . 1.03 109.867 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' GLN . . . . . 0.546 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 53.1 tt0 -69.04 -31.88 70.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.341 -0.391 . . . . 0.75 110.478 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.78 -41.34 99.61 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.18 111.509 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.0 -37.84 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.68 -0.489 . . . . 2.18 109.68 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.0 mp -66.78 -35.97 81.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.676 -0.693 . . . . 1.07 110.793 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.02 -46.95 82.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.77 0.319 . . . . 1.13 110.677 176.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -66.62 -41.46 88.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.094 -0.503 . . . . 1.58 111.768 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.0 tpt85 -74.69 -48.99 22.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.893 0.377 . . . . 2.61 111.387 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -80.73 -22.58 40.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.659 0.614 . . . . 1.14 112.659 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 14.4 mptt 62.99 35.09 13.46 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.679 0.612 . . . . 2.74 110.626 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -156.61 118.95 3.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.058 0.456 . . . . 1.12 110.592 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -67.97 -40.12 83.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.511 -0.768 . . . . 2.32 111.818 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 217' ' ' LYS . 6.5 m-20 -62.46 -51.34 67.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.377 . . . . 2.01 111.307 -173.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -70.81 -31.06 67.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.919 0.39 . . . . 1.48 110.313 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.61 -39.44 91.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 1.03 110.132 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' ASN . . . . . 0.455 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -70.29 -47.36 61.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.63 110.1 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 213' ' ' ASP . 68.0 mttm -60.91 -37.01 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.775 -0.648 . . . . 2.45 111.094 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 44.4 mt -72.48 -39.97 67.28 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.306 -0.407 . . . . 1.08 110.271 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' ARG . . . . . 0.546 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 37.2 ttp180 -55.16 -42.31 72.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.142 0.496 . . . . 1.49 110.288 176.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' VAL . . . . . 0.632 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 85.9 t -71.13 -49.56 47.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.558 -0.746 . . . . 1.13 109.851 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.89 -48.5 78.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.937 -1.029 . . . . 1.09 111.025 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.14 -36.96 85.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 2.18 110.317 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -67.46 -31.73 72.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 1.0 110.846 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.632 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 44.3 mt-10 -75.42 -31.48 60.39 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.466 -0.568 . . . . 2.28 109.466 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.15 -41.63 77.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.428 -0.806 . . . . 0.99 109.662 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 226' ' ' TRP . . . . . 0.475 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 56.0 t90 -64.38 -37.74 88.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.165 -0.925 . . . . 0.21 110.1 177.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.77 -35.0 79.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.227 -0.442 . . . . 2.82 110.756 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 19.7 t -74.95 -9.68 58.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.938 0.399 . . . . 1.85 110.923 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 23.2 t -75.42 -12.51 60.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.166 0.508 . . . . 1.67 110.229 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.651 -0.69 . . . . 2.18 110.327 178.773 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.639 0.256 . . . . 1.46 110.721 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.59 -34.18 56.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 CA-C-O 120.864 0.364 . . . . 1.03 110.809 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 192' ' ' VAL . . . . . 0.442 HG11 ' CE2' ' B' ' 197' ' ' PHE . 39.1 t -71.38 -19.63 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.688 0.756 . . . . 1.07 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 193' ' ' ALA . . . . . 0.478 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.15 11.57 11.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.431 -0.804 . . . . 0.9 111.642 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.6 p -106.05 151.35 24.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.022 0.439 . . . . 1.06 110.165 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.99 -32.88 74.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.637 -0.71 . . . . 2.46 109.245 175.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.68 92.76 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.873 -1.058 . . . . 1.07 111.691 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 197' ' ' PHE . . . . . 0.442 ' CE2' HG11 ' B' ' 192' ' ' VAL . 56.0 t80 -62.25 -50.26 72.44 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.894 0.378 . . . . 0.31 110.093 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.7 -28.91 67.26 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.624 -0.716 . . . . 0.18 111.558 -177.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.88 -47.9 73.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.722 0.296 . . . . 1.25 110.38 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -66.39 -37.71 85.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.995 0.426 . . . . 1.37 110.387 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.74 -47.8 84.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.655 -0.702 . . . . 1.03 109.931 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.54 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 53.6 tt0 -68.95 -31.81 70.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.369 -0.378 . . . . 0.76 110.5 178.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.82 -41.45 99.63 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.749 -0.739 . . . . 0.18 111.512 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.8 -38.0 85.64 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.691 -0.485 . . . . 2.18 109.691 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.0 mp -66.63 -36.03 81.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.737 -0.665 . . . . 1.07 110.806 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -64.03 -46.76 83.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.82 0.343 . . . . 1.14 110.6 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.8 -41.25 87.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 1.58 111.926 -178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -74.87 -49.11 21.59 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.833 0.349 . . . . 2.62 111.292 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 209' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.0 mp -80.67 -22.66 40.24 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.524 0.564 . . . . 1.14 112.524 -175.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 14.3 mptt 62.95 34.98 13.66 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.658 0.599 . . . . 2.74 110.717 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -156.56 118.86 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.076 0.465 . . . . 1.11 110.536 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -67.97 -40.26 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.551 -0.749 . . . . 2.31 111.866 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.12 -51.44 67.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 2.0 111.34 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -70.8 -31.04 67.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.923 0.392 . . . . 1.48 110.274 -178.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.69 -39.4 91.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.412 0.625 . . . . 1.04 110.025 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 216' ' ' ASN . . . . . 0.46 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.3 t-20 -70.25 -47.45 61.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.208 -0.905 . . . . 0.63 110.099 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.9 -37.04 80.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.77 -0.65 . . . . 2.43 111.013 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.1 mt -72.43 -40.01 67.42 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.325 -0.398 . . . . 1.08 110.203 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 219' ' ' ARG . . . . . 0.54 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 36.9 ttp180 -55.14 -42.18 72.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.088 0.47 . . . . 1.49 110.299 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 220' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 79.0 t -71.27 -49.59 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 1.12 109.816 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 60.7 tp -56.73 -48.73 77.11 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.961 -1.018 . . . . 1.09 111.039 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.01 -37.01 86.23 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.462 -0.79 . . . . 2.18 110.291 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.32 -31.96 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.012 -0.275 . . . . 1.0 110.801 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 224' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 43.8 mt-10 -75.21 -31.65 60.95 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.525 -0.546 . . . . 2.27 109.525 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.87 -41.68 78.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.523 -0.762 . . . . 0.98 109.65 175.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 226' ' ' TRP . . . . . 0.478 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 56.3 t90 -64.39 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.251 -0.886 . . . . 0.2 110.132 177.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.9 -34.87 78.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 2.82 110.658 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 24.2 t -74.63 -10.26 59.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.8 0.333 . . . . 1.85 110.891 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.1 t -75.24 -12.56 60.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.181 0.515 . . . . 1.68 110.371 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.636 -0.697 . . . . 2.17 110.467 178.667 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo . . . . . 0 N--CA 1.481 0.755 0 N-CA-C 110.851 -0.48 . . . . 2.13 110.851 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 28.8 p -80.94 -21.83 40.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 2.35 111.181 174.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 108.76 67.98 0.61 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.715 -0.755 . . . . 1.67 112.572 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -167.52 -55.18 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.09 0.471 . . . . 1.96 110.182 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 18.2 m -60.72 -36.5 78.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.767 -0.651 . . . . 1.47 110.954 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.29 -33.92 47.65 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-O 120.779 0.323 . . . . 1.03 110.377 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.445 HG22 HD11 ' B' ' 209' ' ' LEU . 22.3 t -69.89 -19.69 22.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.678 0.751 . . . . 1.08 109.73 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.525 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.21 12.04 10.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.546 -0.752 . . . . 0.9 111.522 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 34.1 p -108.98 146.28 34.12 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.485 0.66 . . . . 1.07 110.562 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.95 -31.57 72.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 2.46 110.012 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.18 -40.5 94.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.4 -0.818 . . . . 1.07 111.427 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.14 -49.98 73.69 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.338 -0.392 . . . . 0.31 109.943 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.82 -29.22 67.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.61 -0.723 . . . . 0.19 111.845 -177.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.38 -48.3 70.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.799 0.333 . . . . 1.23 110.232 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.32 -33.84 73.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 1.37 110.928 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.14 -47.13 86.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.921 -0.581 . . . . 1.03 109.609 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.432 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.6 -32.19 72.76 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.438 -0.347 . . . . 0.75 110.2 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.635 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.02 -41.7 96.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.959 -0.639 . . . . 0.18 111.735 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.14 -41.13 90.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.441 0.638 . . . . 2.18 109.534 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.42 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -63.59 -37.93 89.21 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.094 -0.957 . . . . 1.07 110.434 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -66.76 -42.88 85.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.66 -0.245 . . . . 1.13 110.664 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.635 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 49.7 mt-30 -57.51 -46.07 84.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.878 0.37 . . . . 1.58 111.567 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.96 -41.32 20.97 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.484 0.55 . . . . 2.61 112.484 -175.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.44 HD11 HG22 ' B' ' 192' ' ' VAL . 8.3 mp -86.26 -22.46 26.83 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.049 0.389 . . . . 1.14 112.049 -172.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.53 39.61 17.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.622 -0.717 . . . . 2.74 110.991 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -157.99 117.33 3.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.955 0.407 . . . . 1.12 110.221 -177.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.58 -44.29 82.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.569 -0.741 . . . . 2.32 111.778 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -69.72 -40.67 76.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.532 -0.304 . . . . 2.01 111.142 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 4.6 tp10 -68.31 -40.21 81.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.329 0.585 . . . . 1.48 109.866 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.54 -32.71 74.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.403 -0.817 . . . . 1.03 109.887 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.425 ' O ' HG21 ' A' ' 220' ' ' VAL . 3.9 t-20 -69.76 -44.22 70.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.996 -1.002 . . . . 0.63 110.006 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -56.58 -42.65 79.03 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.132 -0.486 . . . . 2.45 110.389 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 53.7 mt -72.84 -35.18 67.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.656 -0.702 . . . . 1.08 110.502 -177.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . 0.432 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 50.2 ttp180 -57.89 -42.99 85.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.03 0.443 . . . . 1.49 110.271 176.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 60.5 t -71.23 -49.08 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.639 -0.71 . . . . 1.13 109.806 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . 0.4 HD23 ' O ' ' B' ' 225' ' ' ALA . 65.2 tp -57.36 -49.52 75.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.701 -1.136 . . . . 1.09 110.964 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -66.3 -36.92 84.19 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.778 -0.647 . . . . 2.18 110.706 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 88.0 tttt -66.71 -34.54 78.08 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.67 -0.412 . . . . 1.0 110.824 179.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 10.9 mm-40 -75.79 -30.49 59.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.135 0.493 . . . . 2.28 109.822 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.37 -42.94 82.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.592 -0.731 . . . . 0.99 109.482 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.525 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 36.6 t90 -63.28 -36.2 82.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.121 -0.945 . . . . 0.21 110.096 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.7 82.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.263 -0.426 . . . . 2.82 110.626 175.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 14.5 t -76.61 -9.29 58.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.201 -0.454 . . . . 1.85 110.785 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 35.1 t -75.19 -12.03 60.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.193 0.52 . . . . 1.67 110.348 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.695 -0.669 . . . . 2.18 110.355 178.07 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo . . . . . 0 N--CA 1.479 0.665 0 N-CA-C 110.856 -0.478 . . . . 2.12 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 32.7 p -80.16 -22.57 41.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 2.33 111.027 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 109.24 68.35 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.676 -0.773 . . . . 1.68 112.503 178.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -167.96 -55.24 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.116 0.484 . . . . 1.97 110.058 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 17.1 m -60.59 -36.71 79.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.841 -0.618 . . . . 1.46 110.834 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.13 -33.99 48.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 CA-C-O 120.721 0.296 . . . . 1.03 110.269 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . 0.44 HG22 HD11 ' A' ' 209' ' ' LEU . 22.2 t -69.82 -19.68 22.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.573 0.701 . . . . 1.07 109.736 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.521 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.16 11.84 11.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.623 -0.717 . . . . 0.9 111.486 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 34.4 p -108.87 146.17 34.15 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.572 0.701 . . . . 1.06 110.457 -175.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.79 -31.72 72.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.768 -1.105 . . . . 2.46 109.939 176.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.1 -40.29 93.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.518 -0.764 . . . . 1.07 111.487 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.34 -50.1 72.97 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.332 -0.395 . . . . 0.31 109.991 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.71 -29.29 67.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.594 -0.73 . . . . 0.18 111.861 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.3 -48.48 70.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.8 0.333 . . . . 1.25 110.155 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.16 -33.95 74.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.378 -0.374 . . . . 1.37 110.784 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -58.99 -47.16 86.18 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.003 -0.544 . . . . 1.03 109.589 175.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.427 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.67 -32.07 72.48 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 116.459 -0.337 . . . . 0.76 110.328 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.615 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.25 -41.55 96.83 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.968 -0.634 . . . . 0.18 111.594 175.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -66.21 -41.12 90.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.413 0.625 . . . . 2.18 109.509 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.0 mp -63.49 -38.06 89.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.108 -0.951 . . . . 1.07 110.54 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -66.64 -43.16 85.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.672 -0.24 . . . . 1.14 110.552 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 49.7 mt-30 -57.21 -46.13 83.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.429 -0.35 . . . . 1.58 111.588 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -82.09 -41.17 20.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.425 0.528 . . . . 2.62 112.425 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 192' ' ' VAL . 8.4 mp -86.26 -22.68 26.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.982 0.364 . . . . 1.14 111.982 -172.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.45 40.07 17.63 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.909 0.756 . . . . 2.74 110.758 -177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -158.2 117.37 3.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.888 0.375 . . . . 1.11 110.319 -177.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -66.6 -44.28 82.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.604 -0.726 . . . . 2.31 111.801 -177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.75 -41.05 75.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.445 -0.343 . . . . 2.0 111.045 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 4.5 tp10 -67.98 -40.28 83.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.437 0.637 . . . . 1.48 110.002 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.8 74.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 1.04 109.915 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.406 ' O ' HG21 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.56 -44.57 70.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.107 -0.952 . . . . 0.63 110.028 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -56.23 -42.93 78.08 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 116.137 -0.483 . . . . 2.43 110.377 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.2 mt -72.77 -35.04 67.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.689 -0.687 . . . . 1.08 110.578 -177.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . 0.427 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 50.1 ttp180 -57.83 -43.2 85.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.101 0.477 . . . . 1.49 110.18 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 59.6 t -71.16 -49.07 51.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.708 -0.678 . . . . 1.12 109.891 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.3 tp -57.23 -49.75 75.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.756 -1.111 . . . . 1.09 111.035 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -66.24 -36.79 83.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.76 -0.654 . . . . 2.18 110.731 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.551 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 87.9 tttt -66.84 -34.5 77.95 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.663 -0.415 . . . . 1.0 110.795 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 12.0 mm-40 -75.75 -30.2 59.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.095 0.474 . . . . 2.27 109.796 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . 0.4 ' O ' HD23 ' A' ' 221' ' ' LEU . . . -67.64 -42.87 81.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.539 -0.755 . . . . 0.98 109.458 174.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.521 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 36.9 t90 -63.33 -36.23 82.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.207 -0.906 . . . . 0.2 110.151 176.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.99 82.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 2.82 110.386 175.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 19.5 t -76.36 -9.15 58.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.261 -0.427 . . . . 1.85 110.871 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 33.5 t -75.35 -11.81 60.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.057 0.456 . . . . 1.68 110.313 178.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.606 -0.711 . . . . 2.17 110.406 177.712 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.478 0.611 0 N-CA-C 110.17 -0.742 . . . . 2.13 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 18.0 t -118.9 60.13 0.82 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.276 0.56 . . . . 2.35 110.475 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . . . . . . . . . . . 112.85 -109.04 2.27 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.62 -0.8 . . . . 1.67 113.105 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -56.73 -44.28 81.48 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.458 0.54 . . . . 1.96 112.458 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.7 t -42.45 -42.18 3.18 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.28 0.844 . . . . 1.47 113.28 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 14.8 p -86.74 -31.41 6.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.284 -0.567 . . . . 1.03 111.009 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.422 HG21 HD13 ' B' ' 209' ' ' LEU . 28.1 t -68.28 -21.38 26.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.366 0.603 . . . . 1.08 110.231 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.465 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.28 11.36 12.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.99 -0.55 . . . . 0.9 111.354 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 46.1 p -106.32 145.66 31.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.279 0.561 . . . . 1.07 109.998 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -65.45 -32.4 74.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.189 -0.914 . . . . 2.46 109.692 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.76 -37.87 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.366 -0.833 . . . . 1.07 111.745 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -62.68 -50.8 69.72 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.967 -0.383 . . . . 0.31 109.967 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.18 -29.38 67.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.635 -0.711 . . . . 0.19 111.553 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.88 -48.75 70.49 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.028 0.442 . . . . 1.23 110.316 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -72.45 -32.54 66.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 1.37 110.938 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.46 -47.1 85.13 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.037 -0.727 . . . . 1.03 109.037 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.429 ' HB2' ' HD2' ' A' ' 219' ' ' ARG . 49.8 tt0 -66.05 -33.84 76.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.145 -0.479 . . . . 0.75 110.299 176.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.492 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -61.41 -39.82 97.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.829 -0.701 . . . . 0.18 112.068 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.45 -38.64 87.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.542 0.687 . . . . 2.18 109.258 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -65.55 -33.6 76.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.06 -0.973 . . . . 1.07 110.686 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.01 -43.63 87.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.869 0.366 . . . . 1.13 110.476 175.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.492 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 51.4 mt-30 -59.99 -46.99 87.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.989 -0.551 . . . . 1.58 111.532 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.29 -47.02 16.6 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.431 0.53 . . . . 2.61 112.431 -175.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.7 mp -81.87 -21.95 37.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.346 -0.388 . . . . 1.14 111.858 -172.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.56 35.31 20.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 2.74 110.658 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -157.93 118.79 3.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 1.12 110.128 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -68.15 -37.4 81.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.625 -0.716 . . . . 2.32 111.496 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.11 -50.12 62.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.236 -0.438 . . . . 2.01 111.294 -175.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.71 -33.1 74.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.171 0.51 . . . . 1.48 109.925 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.4 87.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.531 0.682 . . . . 1.03 110.115 178.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.483 ' O ' HG22 ' A' ' 220' ' ' VAL . 4.3 t-20 -69.68 -43.02 73.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.248 -0.887 . . . . 0.63 109.759 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.43 -37.8 84.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.566 -0.743 . . . . 2.45 111.215 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . 0.406 HD13 HD22 ' A' ' 209' ' ' LEU . 32.5 mt -72.71 -36.34 67.8 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.829 -0.348 . . . . 1.08 110.44 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . 0.429 ' HD2' ' HB2' ' A' ' 202' ' ' GLN . 64.4 ttt180 -57.25 -41.97 80.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.099 0.476 . . . . 1.49 110.358 175.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 216' ' ' ASN . 88.4 t -70.45 -48.71 58.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.666 -0.697 . . . . 1.13 109.968 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.28 -48.71 80.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.995 -1.002 . . . . 1.09 110.845 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.69 83.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.684 -0.689 . . . . 2.18 110.538 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.8 tttt -67.66 -33.89 75.85 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.705 -0.398 . . . . 1.0 110.798 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 28.3 mm-40 -74.58 -30.64 61.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 2.28 109.69 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.27 -41.35 85.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 0.99 109.411 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.465 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.0 t90 -65.11 -39.36 92.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.066 -0.97 . . . . 0.21 109.963 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.2 mmm180 -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.086 -0.506 . . . . 2.82 111.09 176.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.08 -4.62 36.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.148 0.499 . . . . 1.85 110.972 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 24.3 t -80.22 -14.46 58.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.493 -0.558 . . . . 1.67 109.493 176.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.717 -0.659 . . . . 2.18 110.048 177.631 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.477 0.55 0 N-CA-C 110.284 -0.699 . . . . 2.12 110.284 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 19.8 t -118.72 59.77 0.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 2.33 110.434 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 113.17 -109.09 2.25 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.707 -0.759 . . . . 1.68 113.054 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -56.49 -44.41 80.63 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.529 0.566 . . . . 1.97 112.529 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 31.9 t -42.55 -41.61 3.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.239 0.829 . . . . 1.46 113.239 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 14.9 p -87.18 -31.45 5.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.238 -0.585 . . . . 1.03 111.125 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . 0.403 HG21 HD13 ' A' ' 209' ' ' LEU . 27.7 t -68.11 -21.37 26.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.498 0.666 . . . . 1.07 110.381 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.453 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.52 11.67 12.11 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.907 -0.588 . . . . 0.9 111.373 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 45.1 p -106.34 145.88 31.12 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.245 0.545 . . . . 1.06 110.019 -175.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.71 -32.3 73.78 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.136 -0.938 . . . . 2.46 109.678 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.93 84.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.349 -0.841 . . . . 1.07 111.578 176.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.73 -50.75 69.87 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.902 -0.407 . . . . 0.31 109.902 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.12 -29.4 67.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.634 -0.712 . . . . 0.18 111.662 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -66.14 -48.52 70.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.04 0.448 . . . . 1.25 110.336 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -72.51 -32.57 66.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.226 -0.443 . . . . 1.37 110.95 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.51 -47.15 85.09 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.108 -0.701 . . . . 1.03 109.108 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.444 ' HB2' ' HD2' ' B' ' 219' ' ' ARG . 50.0 tt0 -65.93 -34.03 77.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.76 110.322 176.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.476 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -61.06 -40.37 98.42 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.827 -0.701 . . . . 0.18 112.051 176.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -66.0 -38.61 88.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.646 0.736 . . . . 2.18 109.2 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 2.9 mp -65.58 -33.57 76.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.936 -1.029 . . . . 1.07 110.719 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.93 -44.23 85.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.837 0.351 . . . . 1.14 110.411 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 50.2 mt-30 -59.48 -47.0 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.984 -0.553 . . . . 1.58 111.636 179.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.38 -47.11 16.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.289 0.478 . . . . 2.62 112.289 -175.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.7 mp -81.65 -21.94 37.85 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.845 0.313 . . . . 1.14 111.845 -172.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.28 35.6 20.78 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 124.098 0.874 . . . . 2.74 110.574 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -158.06 118.71 3.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 1.11 110.214 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -68.08 -37.54 81.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.665 -0.698 . . . . 2.31 111.525 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.94 -49.93 63.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.199 -0.455 . . . . 2.0 111.326 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -68.03 -33.13 74.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 1.48 109.965 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.39 87.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 1.04 110.095 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.477 ' O ' HG22 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.63 -43.14 73.3 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.372 -0.831 . . . . 0.63 109.792 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.38 -37.89 85.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.462 -0.79 . . . . 2.43 111.103 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . 0.403 HD13 HD22 ' B' ' 209' ' ' LEU . 32.4 mt -72.59 -36.53 68.17 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.772 -0.371 . . . . 1.08 110.348 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . 0.444 ' HD2' ' HB2' ' B' ' 202' ' ' GLN . 64.0 ttt180 -56.98 -42.08 79.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.064 0.459 . . . . 1.49 110.244 175.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.477 HG22 ' O ' ' B' ' 216' ' ' ASN . 80.1 t -70.48 -48.61 58.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 1.12 109.946 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.7 tp -59.46 -48.53 81.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.956 -1.02 . . . . 1.09 110.817 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.87 84.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.643 -0.708 . . . . 2.18 110.646 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.8 tttt -67.45 -34.12 76.55 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.799 -0.361 . . . . 1.0 110.79 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 28.4 mm-40 -74.61 -30.55 61.72 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.223 0.535 . . . . 2.27 109.728 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.19 -41.26 86.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.483 -0.781 . . . . 0.98 109.452 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.453 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.6 t90 -65.14 -39.33 92.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.02 -0.991 . . . . 0.2 109.984 177.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.3 mmm180 -64.6 -40.16 95.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 2.82 111.075 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.2 t -74.06 -4.94 38.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.046 0.45 . . . . 1.85 110.905 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.4 t -79.76 -14.85 58.42 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.65 -0.5 . . . . 1.68 109.65 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.625 -0.702 . . . . 2.17 110.094 177.655 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.475 0.422 0 N-CA-C 110.466 -0.628 . . . . 2.13 110.466 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.9 t -132.5 60.98 1.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.909 -0.774 . . . . 2.35 108.909 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . . . . . . . . . . . 90.09 -154.71 23.9 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.292 -0.867 . . . . 1.67 111.876 -174.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 30.82 -82.14 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.594 1.558 . . . . 1.96 114.986 175.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 8.7 m -46.51 -45.94 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.327 0.651 . . . . 1.47 112.497 -175.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' B' ' 209' ' ' LEU . 7.5 p -75.29 -30.35 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 1.03 110.812 -179.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 40.4 t -69.6 -20.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.565 0.698 . . . . 1.08 109.701 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.441 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.33 10.95 13.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.574 -0.739 . . . . 0.9 111.404 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 40.1 p -106.56 144.47 33.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.211 0.529 . . . . 1.07 110.005 -175.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.93 -31.23 72.03 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.278 -0.874 . . . . 2.46 109.429 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.65 89.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.106 -0.952 . . . . 1.07 111.247 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -61.71 -48.44 80.74 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.938 0.399 . . . . 0.31 109.971 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.78 -28.67 66.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.572 -0.74 . . . . 0.19 111.664 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -66.37 -48.99 68.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.834 0.349 . . . . 1.23 110.358 174.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.36 -37.91 86.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.05 0.452 . . . . 1.37 110.682 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.18 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.585 -0.734 . . . . 1.03 109.735 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.444 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 60.9 tt0 -64.2 -36.75 85.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.025 -0.534 . . . . 0.75 110.387 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.517 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.0 -41.79 98.07 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.034 -0.603 . . . . 0.18 112.069 177.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -66.56 -39.07 88.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.172 0.51 . . . . 2.18 109.637 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.5 mp -64.98 -34.15 77.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.565 -0.743 . . . . 1.07 110.539 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 47.3 mt-10 -65.97 -43.98 86.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.674 0.274 . . . . 1.13 110.488 176.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.517 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 46.3 mt-30 -62.85 -48.81 77.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.433 . . . . 1.58 111.691 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.8 tpt85 -77.87 -43.61 29.66 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.989 -0.551 . . . . 2.61 111.531 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.606 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 3.1 mp -84.25 -23.29 30.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.243 -0.435 . . . . 1.14 112.16 -176.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.37 36.27 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.84 0.713 . . . . 2.74 111.133 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -156.88 117.09 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.994 -0.548 . . . . 1.12 110.266 -177.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -67.79 -37.19 81.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.684 -0.689 . . . . 2.32 111.355 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -62.58 -50.18 72.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.318 -0.401 . . . . 2.01 110.917 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.49 -37.62 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.972 -0.558 . . . . 1.48 110.005 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.11 -41.65 90.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.82 -0.627 . . . . 1.03 110.618 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.409 ' O ' HG23 ' A' ' 220' ' ' VAL . 0.2 OUTLIER -70.87 -41.94 70.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.597 -0.728 . . . . 0.63 110.253 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -59.95 -43.07 95.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.013 -0.54 . . . . 2.45 110.684 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 63.1 mt -72.91 -34.86 66.88 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.744 -0.662 . . . . 1.08 110.196 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -57.42 -44.32 84.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.134 0.492 . . . . 1.49 110.036 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 216' ' ' ASN . 73.4 t -71.68 -49.23 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.674 -0.694 . . . . 1.13 110.28 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.69 -48.68 80.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.028 -0.987 . . . . 1.09 110.783 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -65.23 -38.85 91.69 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.649 -0.705 . . . . 2.18 110.585 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.3 tttt -65.75 -33.84 76.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.841 -0.343 . . . . 1.0 110.866 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -76.97 -29.33 55.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.944 0.402 . . . . 2.28 110.248 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.74 87.25 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.767 -0.652 . . . . 0.99 109.358 173.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.441 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.7 t90 -63.61 -37.1 86.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.061 -0.972 . . . . 0.21 109.965 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 37.1 mmt180 -62.34 -37.85 87.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.157 -0.474 . . . . 2.82 110.686 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 18.4 t -75.23 -10.05 59.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.308 -0.406 . . . . 1.85 110.962 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.2 t -76.61 -7.35 55.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.037 0.446 . . . . 1.67 109.89 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.708 -0.663 . . . . 2.18 109.894 175.867 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.477 0.508 0 N-CA-C 110.572 -0.588 . . . . 2.12 110.572 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 22.7 t -132.61 61.03 1.68 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.943 -0.762 . . . . 2.33 108.943 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.41 ' HA2' ' HG ' ' A' ' 209' ' ' LEU . . . 89.7 -154.66 24.17 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.504 -0.771 . . . . 1.68 111.859 -174.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 31.05 -82.19 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.462 1.505 . . . . 1.97 114.888 175.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 6.9 m -46.62 -46.09 19.48 Favored 'General case' 0 N--CA 1.462 0.139 0 C-N-CA 123.337 0.655 . . . . 1.46 112.409 -175.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' A' ' 209' ' ' LEU . 7.5 p -74.95 -30.68 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.794 0.331 . . . . 1.03 110.868 -178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.48 -20.79 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.681 0.753 . . . . 1.07 109.74 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.446 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.04 10.9 12.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.42 -0.809 . . . . 0.9 111.551 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 41.5 p -106.75 144.3 33.6 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.216 0.531 . . . . 1.06 109.968 -175.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -65.86 -31.33 72.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.253 -0.885 . . . . 2.46 109.373 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.72 89.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.121 -0.945 . . . . 1.07 111.356 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -61.63 -48.48 80.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.941 -0.392 . . . . 0.31 109.941 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.67 -28.59 67.01 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.666 -0.697 . . . . 0.18 111.707 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.44 -48.99 68.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.72 0.295 . . . . 1.25 110.385 174.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -66.31 -37.97 86.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.966 0.412 . . . . 1.37 110.737 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.2 -47.0 86.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 1.03 109.646 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.446 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 61.1 tt0 -63.85 -36.95 85.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.76 110.459 177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.502 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.18 -41.74 98.32 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.104 -0.569 . . . . 0.18 111.996 177.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -66.48 -39.11 88.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.62 -0.511 . . . . 2.18 109.62 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.4 mp -64.96 -34.1 77.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.623 -0.717 . . . . 1.07 110.434 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 45.2 mt-10 -66.22 -43.49 86.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.734 0.302 . . . . 1.14 110.499 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 46.7 mt-30 -63.22 -48.92 76.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.019 0.437 . . . . 1.58 111.808 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 3.9 tpt85 -77.81 -43.47 30.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.959 -0.564 . . . . 2.62 111.456 -173.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.606 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 2.9 mp -84.17 -23.51 30.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.227 -0.442 . . . . 1.14 112.187 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.54 35.97 26.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.582 -0.735 . . . . 2.74 111.131 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -156.5 117.41 3.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.005 -0.543 . . . . 1.11 110.238 -177.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -67.85 -37.42 81.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.766 -0.652 . . . . 2.31 111.367 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.45 -50.31 71.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 2.0 110.817 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.44 -37.37 87.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.084 -0.507 . . . . 1.48 109.957 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.32 -41.59 89.43 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.887 -0.597 . . . . 1.04 110.644 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.407 ' O ' HG23 ' B' ' 220' ' ' VAL . 0.2 OUTLIER -70.77 -42.28 70.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.665 -0.698 . . . . 0.63 110.184 -179.402 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -59.71 -43.07 94.27 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.948 -0.569 . . . . 2.43 110.67 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 63.3 mt -72.94 -34.75 66.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.85 -0.614 . . . . 1.08 110.241 -178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -57.66 -44.28 85.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.06 0.457 . . . . 1.49 110.06 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 216' ' ' ASN . 66.7 t -71.54 -49.45 46.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.749 -0.659 . . . . 1.12 110.277 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.9 tp -58.3 -48.7 79.67 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.002 -0.999 . . . . 1.09 110.981 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -65.13 -38.93 92.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.668 -0.696 . . . . 2.18 110.577 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.2 tttt -65.56 -34.08 77.42 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.926 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -76.92 -29.33 55.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.09 0.471 . . . . 2.27 110.096 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.47 -42.65 87.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.29 -0.633 . . . . 0.98 109.29 173.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.446 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 52.6 t90 -63.62 -37.08 85.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.995 -1.002 . . . . 0.2 110.017 176.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 37.0 mmt180 -62.37 -37.63 86.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 2.82 110.859 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.9 t -75.58 -9.95 59.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 1.85 110.788 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 19.4 t -76.46 -7.84 55.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.172 0.51 . . . . 1.68 110.054 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.652 -0.689 . . . . 2.17 109.849 175.893 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.412 ' HB2' ' HB ' ' A' ' 191' ' ' VAL . 9.5 Cg_endo . . . . . 0 N--CA 1.481 0.747 0 N-CA-C 110.703 -0.537 . . . . 2.13 110.703 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 41.1 m 56.46 150.91 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 122.002 0.906 . . . . 2.35 113.43 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.45 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . -82.64 53.93 4.87 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.877 -0.678 . . . . 1.67 112.099 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -173.71 -57.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 1.96 109.759 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m -50.86 -50.37 57.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.713 -0.676 . . . . 1.47 112.102 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.412 ' HB ' ' HB2' ' A' ' 186' ' ' PRO . 11.9 p -70.06 -32.85 52.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.773 -0.371 . . . . 1.03 110.939 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 22.1 t -66.97 -19.85 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.69 0.757 . . . . 1.08 109.749 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.469 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -90.04 12.2 18.41 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.613 -0.721 . . . . 0.9 111.597 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 42.8 p -107.86 152.18 24.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.227 0.536 . . . . 1.07 110.362 -176.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.51 -32.69 74.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.385 -0.825 . . . . 2.46 109.708 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.61 90.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.23 -0.896 . . . . 1.07 111.863 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -62.35 -50.94 69.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.31 110.236 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -69.18 -28.27 66.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.705 -0.679 . . . . 0.19 111.448 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.66 -51.98 65.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 1.23 110.509 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.65 -32.5 65.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.275 -0.42 . . . . 1.37 111.371 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.86 -47.78 83.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.166 -0.679 . . . . 1.03 109.166 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.2 tt0 -67.0 -33.18 75.0 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.925 -0.58 . . . . 0.75 110.195 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.447 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.77 -40.12 97.7 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.928 -0.653 . . . . 0.18 111.906 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -67.16 -38.73 85.98 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.528 -0.545 . . . . 2.18 109.528 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.7 mp -66.19 -38.19 87.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.529 -0.76 . . . . 1.07 110.561 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.7 mt-10 -63.36 -48.54 77.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.362 . . . . 1.13 110.863 176.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 95.9 mt-30 -66.24 -40.94 90.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.357 -0.383 . . . . 1.58 112.011 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -77.75 -48.47 16.57 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.814 0.301 . . . . 2.61 111.814 -177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.1 mp -82.31 -23.34 35.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 1.14 111.784 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.409 ' HE3' ' O ' ' A' ' 207' ' ' GLN . 33.9 mmtp 58.76 39.82 23.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.274 -0.875 . . . . 2.74 110.487 -174.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -153.1 109.4 3.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.572 -0.74 . . . . 1.12 109.812 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -67.61 -36.43 80.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.279 -0.419 . . . . 2.32 111.497 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -64.05 -50.4 68.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.871 0.367 . . . . 2.01 110.712 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 8.6 tp10 -70.67 -29.86 66.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.095 -0.502 . . . . 1.48 110.29 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.35 85.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.547 0.689 . . . . 1.03 109.752 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.405 ' O ' HG22 ' A' ' 220' ' ' VAL . 3.2 t-20 -70.1 -46.25 65.25 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.066 -0.97 . . . . 0.63 110.318 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -59.07 -40.72 86.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 2.45 110.899 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.63 -36.89 68.14 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.003 -0.544 . . . . 1.08 110.38 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -58.94 -42.55 90.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.926 0.393 . . . . 1.49 110.388 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 216' ' ' ASN . 88.9 t -71.13 -44.63 74.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.924 -0.58 . . . . 1.13 109.707 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.0 tp -57.24 -50.86 71.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.891 -1.049 . . . . 1.09 110.89 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.75 -37.14 81.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.212 -0.904 . . . . 2.18 110.591 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.6 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.7 tttt -66.09 -36.38 83.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.537 -0.301 . . . . 1.0 110.68 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.192 0.52 . . . . 2.28 110.042 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.17 -40.57 86.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.493 -0.776 . . . . 0.99 109.346 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.469 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 47.5 t90 -67.35 -39.81 85.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.063 -0.971 . . . . 0.21 110.366 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.6 mmm180 -61.32 -39.06 89.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.966 0.412 . . . . 2.82 110.467 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.06 -6.21 46.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 1.85 111.131 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 65.8 m -84.52 -9.59 58.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.989 0.423 . . . . 1.67 110.667 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.289 -0.862 . . . . 2.18 110.184 176.074 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . 0.419 ' HB2' ' HB ' ' B' ' 191' ' ' VAL . 9.3 Cg_endo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.514 -0.61 . . . . 2.12 110.514 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 41.4 m 56.49 150.69 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.219 -0.9 . . . . 2.33 113.345 -177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . -82.27 54.1 4.84 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.897 -0.668 . . . . 1.68 112.166 176.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -173.83 -56.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.693 -0.484 . . . . 1.97 109.693 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m -50.85 -50.4 56.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.83 -0.623 . . . . 1.46 111.959 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . 0.419 ' HB ' ' HB2' ' B' ' 186' ' ' PRO . 12.1 p -70.18 -32.95 52.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 C-N-CA 120.961 -0.296 . . . . 1.03 110.883 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 22.4 t -66.95 -19.88 26.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.619 0.723 . . . . 1.07 109.747 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.473 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -90.1 12.37 17.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.613 -0.721 . . . . 0.9 111.432 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.99 152.12 24.9 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.376 0.607 . . . . 1.06 110.355 -176.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.4 -32.65 74.16 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.295 -0.866 . . . . 2.46 109.826 176.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.75 90.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.331 -0.85 . . . . 1.07 111.856 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -62.16 -51.08 69.28 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.31 110.196 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -69.1 -28.13 66.21 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.621 -0.718 . . . . 0.18 111.536 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.64 -51.96 65.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.851 0.358 . . . . 1.25 110.487 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.68 -32.52 65.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 1.37 111.386 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.13 -47.58 84.76 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.194 -0.669 . . . . 1.03 109.194 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.0 tt0 -66.99 -33.31 75.3 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.76 110.252 176.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.75 -40.13 97.69 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 121.076 -0.583 . . . . 0.18 112.007 176.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -67.01 -38.73 86.47 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.566 -0.531 . . . . 2.18 109.566 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.6 mp -66.08 -38.38 88.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.433 -0.803 . . . . 1.07 110.528 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.8 mt-10 -63.24 -48.81 76.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.841 0.353 . . . . 1.14 110.801 176.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 95.8 mt-30 -66.09 -40.93 91.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.196 -0.456 . . . . 1.58 111.971 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -77.8 -48.53 16.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.753 0.311 . . . . 2.62 111.731 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.1 mp -82.38 -23.12 35.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.815 0.302 . . . . 1.14 111.815 -175.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' B' ' 207' ' ' GLN . 33.9 mmtp 58.47 39.8 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.393 -0.822 . . . . 2.74 110.484 -174.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.05 109.72 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.507 -0.769 . . . . 1.11 109.736 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -67.55 -36.28 80.66 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.275 -0.421 . . . . 2.31 111.49 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.33 -50.19 68.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.86 0.362 . . . . 2.0 110.804 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 8.3 tp10 -70.78 -29.88 66.2 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.126 -0.488 . . . . 1.48 110.113 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.23 85.63 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.516 0.674 . . . . 1.04 109.641 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.411 ' O ' HG22 ' B' ' 220' ' ' VAL . 3.3 t-20 -70.22 -46.63 64.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.14 -0.936 . . . . 0.63 110.27 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -58.65 -40.79 84.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 2.43 110.912 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.71 -36.61 67.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.002 -0.544 . . . . 1.08 110.364 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -59.04 -42.63 90.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.898 0.38 . . . . 1.49 110.367 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.411 HG22 ' O ' ' B' ' 216' ' ' ASN . 84.6 t -71.23 -44.6 73.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.42 0.628 . . . . 1.12 109.678 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.12 -50.73 71.89 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.945 -1.025 . . . . 1.09 110.915 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.99 -37.34 81.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 2.18 110.609 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.601 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.7 tttt -65.87 -36.38 83.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.505 -0.316 . . . . 1.0 110.716 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.21 -31.64 64.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.133 0.492 . . . . 2.27 109.921 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.62 86.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.98 109.341 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.473 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 47.1 t90 -67.49 -39.57 85.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.029 -0.987 . . . . 0.2 110.283 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.2 mmm180 -61.29 -39.34 90.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 2.82 110.423 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.31 -5.56 42.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 1.85 111.167 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 59.6 m -84.84 -9.81 57.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.045 0.45 . . . . 1.68 110.64 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.579 -0.724 . . . . 2.17 110.189 175.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo . . . . . 0 N--CA 1.475 0.39 0 N-CA-C 110.613 -0.572 . . . . 2.13 110.613 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 16.7 p -89.0 67.98 8.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.259 -0.428 . . . . 2.35 112.135 -173.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.659 ' O ' HG12 ' A' ' 191' ' ' VAL . . . 80.77 -92.32 1.43 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.858 -0.687 . . . . 1.67 113.139 174.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.67 -35.52 79.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.481 . . . . 1.96 111.061 -174.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 42.4 t -54.74 -37.05 65.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 1.47 111.895 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 188' ' ' GLY . 9.5 p -79.56 -25.8 12.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 C-N-CA 120.231 -0.587 . . . . 1.03 110.034 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.4 ' HA ' ' CG ' ' A' ' 197' ' ' PHE . 51.2 t -69.05 -25.0 28.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.411 0.625 . . . . 1.08 109.815 176.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.465 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -82.64 12.05 5.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.726 -0.67 . . . . 0.9 111.842 -177.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.03 153.01 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.918 0.389 . . . . 1.07 110.487 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.97 -34.77 78.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.866 -0.606 . . . . 2.46 109.747 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.26 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.453 -0.794 . . . . 1.07 111.829 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 59.3 t80 -61.9 -51.13 69.41 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.824 0.345 . . . . 0.31 110.099 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . 0.413 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 97.2 m95 -69.02 -28.38 66.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.496 -0.775 . . . . 0.19 111.54 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.17 -49.77 70.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.279 -0.418 . . . . 1.23 110.408 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.01 -33.7 70.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 1.37 110.904 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . 0.411 ' O ' HD11 ' A' ' 205' ' ' LEU . 1.7 tm? -59.49 -47.63 84.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.378 -0.601 . . . . 1.03 109.378 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.5 tt0 -66.47 -33.47 75.76 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.089 -0.505 . . . . 0.75 110.272 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.8 -41.28 99.08 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 121.049 -0.596 . . . . 0.18 111.929 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -66.95 -38.4 86.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 2.18 109.784 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.8 mp -65.22 -37.76 88.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.582 -0.735 . . . . 1.07 110.475 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 49.7 mt-10 -65.9 -45.41 82.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.567 -0.288 . . . . 1.13 110.828 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.0 mt-30 -61.97 -48.29 81.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.931 0.396 . . . . 1.58 111.459 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -72.75 -48.31 39.57 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.941 -0.572 . . . . 2.61 111.383 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 6.6 mp -83.13 -23.12 33.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.079 -0.509 . . . . 1.14 111.352 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.56 39.97 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.222 -0.899 . . . . 2.74 109.928 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.85 113.75 3.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.624 -0.716 . . . . 1.12 110.434 -176.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -67.87 -33.85 75.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.853 -0.612 . . . . 2.32 111.244 -177.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.67 -51.11 61.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.449 . . . . 2.01 111.026 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -68.82 -35.09 76.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 1.48 109.988 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.82 -39.34 87.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.738 -0.664 . . . . 1.03 110.486 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.441 ' O ' HG21 ' A' ' 220' ' ' VAL . 3.1 t-20 -66.98 -48.31 68.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.57 -0.741 . . . . 0.63 110.311 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.99 -39.22 77.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.88 -0.6 . . . . 2.45 111.027 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 42.7 mt -72.66 -39.43 67.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.138 -0.483 . . . . 1.08 110.9 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.26 -41.02 87.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.059 0.457 . . . . 1.49 110.179 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 87.3 t -70.24 -44.69 77.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.689 -0.687 . . . . 1.13 109.66 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.0 -49.89 76.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.98 -1.009 . . . . 1.09 110.624 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -68.1 -38.56 82.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.329 -0.85 . . . . 2.18 110.852 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.8 tttt -67.11 -36.16 81.34 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.823 -0.351 . . . . 1.0 110.821 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 47.3 mm-40 -75.38 -28.9 59.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.04 0.447 . . . . 2.28 110.024 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.2 -40.04 82.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.65 -0.705 . . . . 0.99 109.301 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.465 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 51.5 t90 -64.7 -40.21 94.98 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.917 -1.038 . . . . 0.21 109.851 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.8 mmm180 -62.97 -39.99 96.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.997 -0.547 . . . . 2.82 110.661 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 25.9 t -73.48 -6.1 44.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 1.85 111.116 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.0 t -79.28 -13.56 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.154 0.502 . . . . 1.67 109.756 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.576 -0.726 . . . . 2.18 110.01 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.475 0.425 0 N-CA-C 110.71 -0.535 . . . . 2.12 110.71 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 14.7 p -88.85 68.42 8.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.024 0.44 . . . . 2.33 112.034 -173.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.666 ' O ' HG12 ' B' ' 191' ' ' VAL . . . 80.56 -92.18 1.41 Allowed Glycine 0 C--O 1.226 -0.389 0 C-N-CA 120.986 -0.626 . . . . 1.68 113.237 174.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.66 -35.7 80.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.064 0.459 . . . . 1.97 111.158 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 43.9 t -54.52 -37.17 65.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.879 -0.6 . . . . 1.46 111.931 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . 0.666 HG12 ' O ' ' B' ' 188' ' ' GLY . 9.4 p -79.58 -25.71 12.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 120.262 -0.575 . . . . 1.03 109.96 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 51.5 t -69.09 -25.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.423 0.63 . . . . 1.07 109.8 176.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -82.38 11.82 5.12 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.763 -0.653 . . . . 0.9 111.949 -177.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.01 153.07 23.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.967 0.413 . . . . 1.06 110.49 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.0 -34.59 78.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.756 -0.656 . . . . 2.46 109.823 176.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.79 84.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.343 -0.844 . . . . 1.07 111.828 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -61.81 -51.14 69.49 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.31 110.134 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . 0.422 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 97.2 m95 -69.17 -28.31 66.29 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.511 -0.768 . . . . 0.18 111.453 -178.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.11 -49.8 70.79 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.232 -0.44 . . . . 1.25 110.473 174.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.12 -33.75 70.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 1.37 110.864 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . 0.408 ' O ' HD11 ' B' ' 205' ' ' LEU . 1.8 tm? -59.23 -47.88 83.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.326 -0.62 . . . . 1.03 109.326 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.421 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.4 tt0 -66.25 -33.63 76.18 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.969 -0.56 . . . . 0.76 110.349 176.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.67 -41.07 98.79 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.057 -0.592 . . . . 0.18 111.873 176.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -67.32 -38.37 84.82 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.668 -0.493 . . . . 2.18 109.668 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.9 mp -65.13 -37.69 88.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.755 . . . . 1.07 110.55 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 49.3 mt-10 -65.77 -45.82 81.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.589 -0.278 . . . . 1.14 110.873 177.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 52.9 mt-30 -61.74 -48.27 81.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 1.58 111.375 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' B' ' 208' ' ' ARG . 4.4 tpt180 -72.66 -48.18 41.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.81 -0.632 . . . . 2.62 111.482 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.6 mp -83.43 -23.02 32.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.05 -0.523 . . . . 1.14 111.496 -176.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.67 39.62 30.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.254 -0.885 . . . . 2.74 109.928 -175.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.79 113.52 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.594 -0.73 . . . . 1.11 110.32 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -67.84 -33.71 75.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.792 -0.64 . . . . 2.31 111.22 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.8 -51.09 61.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.233 -0.44 . . . . 2.0 110.91 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.95 -35.09 76.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.858 -0.61 . . . . 1.48 109.957 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.31 87.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.759 -0.655 . . . . 1.04 110.45 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.442 ' O ' HG21 ' B' ' 220' ' ' VAL . 3.3 t-20 -66.93 -48.46 68.55 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.56 -0.745 . . . . 0.63 110.382 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.97 -39.04 77.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.917 -0.583 . . . . 2.43 111.011 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.82 -39.46 66.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.207 -0.451 . . . . 1.08 110.916 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.17 -41.15 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 1.49 110.236 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 90.1 t -70.24 -44.66 77.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.684 -0.689 . . . . 1.12 109.647 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 61.0 tp -59.06 -49.61 77.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.869 -1.059 . . . . 1.09 110.683 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -68.33 -38.35 81.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.428 -0.805 . . . . 2.18 110.869 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.9 tttt -67.2 -36.23 81.3 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.837 -0.345 . . . . 1.0 110.89 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 49.7 mm-40 -75.34 -28.74 59.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 2.27 110.056 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.94 81.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.639 -0.71 . . . . 0.98 109.313 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.3 t90 -64.8 -40.05 94.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.846 -1.07 . . . . 0.2 109.854 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.7 mmm180 -63.12 -40.08 96.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.867 -0.606 . . . . 2.82 110.693 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.6 t -73.38 -5.84 42.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.858 0.361 . . . . 1.85 111.108 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 20.9 t -79.35 -13.71 59.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.157 0.503 . . . . 1.68 109.847 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.245 0.832 0 CA-C-O 118.58 -0.724 . . . . 2.17 110.142 177.513 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 N--CA 1.478 0.562 0 N-CA-C 110.274 -0.702 . . . . 2.13 110.274 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 33.2 t -158.19 66.06 0.46 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.039 0.447 . . . . 2.35 110.802 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.53 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 54.86 37.23 61.59 Favored Glycine 0 C--O 1.225 -0.451 0 N-CA-C 115.027 0.771 . . . . 1.67 115.027 175.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -174.89 -48.84 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.427 0.632 . . . . 1.96 109.908 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 2.5 p -59.85 -29.3 68.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.155 -0.93 . . . . 1.47 110.818 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 14.4 p -76.36 -30.36 19.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 116.236 -0.438 . . . . 1.03 110.185 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.409 HG21 HD11 ' B' ' 209' ' ' LEU . 60.7 t -69.7 -23.68 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.545 0.688 . . . . 1.08 109.614 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.407 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.24 12.43 5.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.477 -0.783 . . . . 0.9 111.505 -178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.82 150.23 27.27 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.076 0.465 . . . . 1.07 110.494 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.41 -34.14 77.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.417 -0.811 . . . . 2.46 109.844 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.0 -35.33 78.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.165 -0.925 . . . . 1.07 111.809 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 58.9 t80 -63.87 -51.04 66.4 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.865 0.364 . . . . 0.31 110.123 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . 0.446 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 93.9 m95 -68.11 -29.89 68.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 0.19 111.255 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.9 -43.92 78.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.432 -0.349 . . . . 1.23 110.338 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -71.7 -35.85 70.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.212 0.53 . . . . 1.37 109.75 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.65 -47.73 83.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.426 -0.806 . . . . 1.03 109.348 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.509 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.62 -28.68 67.95 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.196 -0.457 . . . . 0.75 110.204 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.27 -41.77 98.46 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.854 -0.689 . . . . 0.18 111.599 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -66.81 -38.24 86.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 2.18 109.87 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.1 mp -66.5 -40.03 89.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.754 -0.657 . . . . 1.07 110.698 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.13 -43.61 91.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.568 0.223 . . . . 1.13 110.939 177.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' A' ' 210' ' ' LYS . 49.4 mt-30 -60.8 -48.94 79.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.823 0.344 . . . . 1.58 111.707 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.24 -43.49 51.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.153 -0.476 . . . . 2.61 111.55 -173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.9 mp -88.28 -23.71 23.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.218 -0.446 . . . . 1.14 112.202 -174.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' A' ' 207' ' ' GLN . 75.5 mmtt 55.09 38.61 30.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.868 -0.605 . . . . 2.74 110.679 -175.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -150.03 110.68 4.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 1.12 109.351 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -65.29 -38.98 91.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.133 -0.485 . . . . 2.32 111.46 -175.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.37 -50.42 69.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.264 -0.425 . . . . 2.01 111.02 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 5.0 tp10 -69.23 -35.1 75.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.002 0.43 . . . . 1.48 110.461 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.47 89.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.359 0.6 . . . . 1.03 110.203 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.45 ' O ' HG22 ' A' ' 220' ' ' VAL . 2.7 t-20 -70.19 -45.38 66.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.164 -0.925 . . . . 0.63 109.904 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -58.0 -40.44 80.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.645 -0.707 . . . . 2.45 111.134 177.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.47 -37.51 68.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.16 -0.473 . . . . 1.08 110.455 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 48.4 ttp180 -56.36 -41.44 76.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.103 0.478 . . . . 1.49 110.155 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.61 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 89.2 t -70.57 -49.1 54.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.509 -0.768 . . . . 1.13 109.901 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.76 -48.74 78.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.867 -1.061 . . . . 1.09 110.829 -177.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -66.27 -38.32 87.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.61 -0.723 . . . . 2.18 110.524 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.2 tttt -64.4 -36.9 85.67 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.826 -0.35 . . . . 1.0 110.81 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.61 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 51.9 mt-10 -73.96 -30.59 62.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 2.28 109.735 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.5 -43.51 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.511 -0.768 . . . . 0.99 109.658 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.407 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 57.0 t90 -64.69 -39.96 94.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.21 110.08 177.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.8 mmm180 -63.21 -39.23 94.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 2.82 111.088 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 22.0 m -73.98 -5.01 38.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.499 -0.319 . . . . 1.85 111.446 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 27.4 t -79.66 -11.53 59.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.281 0.562 . . . . 1.67 109.749 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.435 -0.793 . . . . 2.18 110.205 178.231 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo . . . . . 0 N--CA 1.479 0.662 0 N-CA-C 110.184 -0.737 . . . . 2.12 110.184 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 34.2 t -157.73 65.76 0.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.065 0.459 . . . . 2.33 110.674 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.589 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 55.37 37.13 64.82 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 114.939 0.736 . . . . 1.68 114.939 175.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -174.99 -48.7 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 117.447 0.624 . . . . 1.97 109.872 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 2.7 p -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.32 -0.855 . . . . 1.46 110.746 177.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 14.5 p -76.12 -30.16 20.15 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.372 -0.376 . . . . 1.03 110.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . 0.427 HG21 HD11 ' A' ' 209' ' ' LEU . 60.5 t -69.82 -23.45 25.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.541 0.686 . . . . 1.07 109.585 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.409 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 12.25 5.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.543 -0.753 . . . . 0.9 111.516 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 42.1 p -107.58 150.18 27.16 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.191 0.519 . . . . 1.06 110.446 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.41 -34.21 77.76 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.358 -0.837 . . . . 2.46 109.777 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.29 78.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.267 -0.878 . . . . 1.07 111.798 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -63.79 -50.86 67.33 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 120.914 0.388 . . . . 0.31 110.207 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . 0.451 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 94.0 m95 -68.39 -29.86 68.65 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.756 -0.657 . . . . 0.18 111.238 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -67.81 -43.6 79.26 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.836 0.35 . . . . 1.25 110.557 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.0 -35.76 69.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.326 0.584 . . . . 1.37 109.84 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.7 -47.71 83.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 1.03 109.31 175.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.497 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.61 -28.81 68.06 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 116.157 -0.474 . . . . 0.76 110.24 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.21 -41.63 98.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.793 -0.718 . . . . 0.18 111.623 174.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -66.9 -38.07 85.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.004 0.43 . . . . 2.18 109.856 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.444 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.2 mp -66.77 -40.01 88.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.724 -0.671 . . . . 1.07 110.623 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.96 -43.73 91.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.805 -0.18 . . . . 1.14 110.896 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' B' ' 210' ' ' LYS . 49.2 mt-30 -61.25 -48.08 83.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 1.58 111.882 177.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.62 -43.64 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.21 -0.45 . . . . 2.62 111.476 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.1 mp -88.2 -23.88 23.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.065 -0.516 . . . . 1.14 112.085 -174.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' B' ' 207' ' ' GLN . 75.4 mmtt 55.4 38.31 30.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.753 -0.658 . . . . 2.74 110.689 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -149.64 110.76 4.38 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.701 -0.682 . . . . 1.11 109.476 -176.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -64.98 -39.13 93.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 2.31 111.611 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -63.33 -50.5 69.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.388 -0.369 . . . . 2.0 111.089 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 4.9 tp10 -69.3 -35.1 75.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 1.48 110.362 -176.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.04 -39.56 90.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.429 0.633 . . . . 1.04 110.209 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 220' ' ' VAL . 2.7 t-20 -70.26 -45.37 66.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.181 -0.918 . . . . 0.63 109.929 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -58.0 -40.48 80.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 2.43 111.059 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 57.9 mt -72.4 -37.54 68.65 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.165 -0.47 . . . . 1.08 110.519 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 48.3 ttp180 -56.43 -41.33 76.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 1.49 110.221 175.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 93.5 t -70.57 -49.11 54.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.548 -0.751 . . . . 1.12 109.866 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.07 -48.6 79.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.849 -1.069 . . . . 1.09 110.793 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -66.23 -38.22 87.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.632 -0.713 . . . . 2.18 110.552 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.1 tttt -64.59 -36.73 85.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.835 -0.346 . . . . 1.0 110.783 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 54.1 mt-10 -74.13 -30.57 62.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.611 -0.514 . . . . 2.27 109.611 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.46 -43.72 84.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.621 -0.718 . . . . 0.98 109.67 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.409 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 57.2 t90 -64.64 -39.76 94.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.323 -0.853 . . . . 0.2 110.096 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.9 mmm180 -63.58 -39.13 93.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 2.82 110.985 177.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.2 m -74.07 -4.57 36.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.556 -0.293 . . . . 1.85 111.353 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 25.1 t -79.89 -11.78 59.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 1.68 109.78 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.49 -0.767 . . . . 2.17 110.134 178.185 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 N--CA 1.477 0.554 0 N-CA-C 110.021 -0.8 . . . . 2.13 110.021 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.8 t -133.76 69.1 1.47 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.173 0.511 . . . . 2.35 110.599 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . . . . . . . . . . . 117.25 -116.87 3.63 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.624 -0.798 . . . . 1.67 113.524 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.97 -40.77 90.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.053 0.76 . . . . 1.96 113.053 -169.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 23.2 t -50.51 -41.85 54.14 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.618 0.599 . . . . 1.47 112.618 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.65 -28.03 12.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.321 -0.552 . . . . 1.03 110.491 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.407 HG22 HD12 ' B' ' 209' ' ' LEU . 40.7 t -68.5 -23.26 27.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.506 0.67 . . . . 1.08 109.912 177.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.454 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.61 12.28 6.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.725 -0.671 . . . . 0.9 111.658 -178.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 48.4 p -106.9 145.67 31.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.246 0.546 . . . . 1.07 110.108 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.13 -32.15 73.7 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.38 -0.827 . . . . 2.46 109.776 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.63 -36.47 82.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.736 -0.665 . . . . 1.07 111.564 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -61.8 -50.9 70.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.016 0.436 . . . . 0.31 109.959 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -69.07 -28.58 66.66 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.19 111.463 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.56 -49.39 71.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 1.23 110.281 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -72.68 -33.58 66.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.247 -0.433 . . . . 1.37 111.137 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.96 -47.53 84.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.229 -0.656 . . . . 1.03 109.229 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.483 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 55.7 tt0 -65.94 -35.54 80.89 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.954 -0.566 . . . . 0.75 110.302 175.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -58.74 -41.96 96.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.033 -0.603 . . . . 0.18 112.017 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -67.44 -38.12 84.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.456 -0.572 . . . . 2.18 109.456 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.5 mp -65.91 -35.44 80.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.394 -0.821 . . . . 1.07 110.68 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.9 mt-10 -64.53 -48.89 73.42 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.94 0.4 . . . . 1.13 110.48 177.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 48.4 mt-30 -65.44 -41.83 93.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.908 -0.587 . . . . 1.58 111.622 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.64 -50.78 16.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.176 -0.465 . . . . 2.61 111.447 -177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.0 mp -78.16 -22.11 49.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 1.14 112.071 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.57 16.12 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.899 0.749 . . . . 2.74 110.464 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.4 118.97 3.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.237 -0.438 . . . . 1.12 110.384 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -68.7 -37.78 79.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.771 -0.649 . . . . 2.32 111.609 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.82 -49.66 71.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.401 -0.363 . . . . 2.01 111.096 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.62 -31.09 70.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.198 0.523 . . . . 1.48 110.04 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.26 84.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 1.03 110.029 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.8 t-20 -69.2 -44.51 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.516 -0.765 . . . . 0.63 109.978 177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.18 -41.51 84.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.851 -0.613 . . . . 2.45 110.887 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 40.8 mt -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.105 -0.498 . . . . 1.08 110.731 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -59.96 -43.67 94.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.023 0.44 . . . . 1.49 110.184 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.607 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 64.5 t -70.48 -46.7 69.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.694 -0.685 . . . . 1.13 109.546 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.19 -49.07 78.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.02 -0.991 . . . . 1.09 110.728 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -67.72 -36.82 81.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.508 -0.769 . . . . 2.18 110.579 -178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.3 tttt -68.42 -33.86 74.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.638 0.256 . . . . 1.0 110.96 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 51.1 mm-40 -75.4 -29.25 59.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.326 0.584 . . . . 2.28 109.723 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.31 83.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.384 -0.825 . . . . 0.99 109.2 174.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.454 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -65.52 -38.59 90.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.957 -1.02 . . . . 0.21 109.892 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 40.4 mmt180 -58.98 -41.13 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 2.82 110.383 173.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 17.6 m -73.85 -10.0 59.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 1.85 111.49 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 15.9 t -74.59 -13.77 60.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.871 0.367 . . . . 1.67 110.613 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.655 -0.688 . . . . 2.18 110.154 178.593 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.477 0.504 0 N-CA-C 109.974 -0.818 . . . . 2.12 109.974 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 24.0 t -133.9 69.24 1.47 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.154 0.502 . . . . 2.33 110.689 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 117.54 -117.05 3.66 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.636 -0.792 . . . . 1.68 113.603 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -59.97 -40.68 89.91 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.127 0.788 . . . . 1.97 113.127 -169.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 22.9 t -50.48 -41.76 53.62 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.502 0.556 . . . . 1.46 112.502 -175.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -80.1 -27.82 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.388 -0.525 . . . . 1.03 110.536 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.5 t -68.48 -23.39 28.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.502 0.668 . . . . 1.07 110.003 177.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.46 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 11.96 6.32 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.596 -0.729 . . . . 0.9 111.555 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 47.5 p -106.34 145.79 31.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.168 0.508 . . . . 1.06 110.199 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.2 -32.15 73.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.457 -0.792 . . . . 2.46 109.751 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.23 82.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.682 -0.69 . . . . 1.07 111.625 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.91 -50.94 70.15 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.848 -0.427 . . . . 0.31 109.848 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -68.95 -28.79 66.96 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.39 -0.823 . . . . 0.18 111.557 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.48 -49.53 71.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.321 -0.4 . . . . 1.25 110.229 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.48 -33.63 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 1.37 111.189 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.95 -47.54 84.71 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.228 -0.656 . . . . 1.03 109.228 175.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.47 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 55.8 tt0 -65.91 -35.24 80.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.018 -0.537 . . . . 0.76 110.324 175.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.02 -42.01 96.73 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.046 -0.597 . . . . 0.18 112.168 177.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -67.35 -38.1 84.29 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.574 -0.528 . . . . 2.18 109.574 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.5 mp -65.94 -35.48 80.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.493 -0.776 . . . . 1.07 110.624 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.6 mt-10 -64.66 -48.68 73.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.794 0.33 . . . . 1.14 110.423 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 48.7 mt-30 -65.72 -41.65 92.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 1.58 111.564 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.59 -50.8 16.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.505 . . . . 2.62 111.431 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.0 mp -78.27 -22.19 48.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 1.14 112.089 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.64 16.09 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.907 0.755 . . . . 2.74 110.549 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.33 119.02 3.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 1.11 110.393 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -68.65 -37.64 79.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.831 -0.622 . . . . 2.31 111.557 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.0 -49.63 71.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.839 0.352 . . . . 2.0 111.035 -175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -68.83 -30.82 69.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.957 -0.565 . . . . 1.48 110.045 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.15 84.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.765 -0.652 . . . . 1.04 110.092 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.9 t-20 -69.17 -44.59 71.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.499 -0.773 . . . . 0.63 109.985 177.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.15 -41.31 83.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 2.43 111.001 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 40.1 mt -73.21 -36.62 66.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.063 -0.517 . . . . 1.08 110.682 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -60.0 -43.4 95.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.992 0.425 . . . . 1.49 110.218 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 62.0 t -70.6 -46.95 67.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 1.12 109.539 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.0 -48.87 78.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.924 -1.035 . . . . 1.09 110.855 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -67.82 -37.07 81.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.467 -0.788 . . . . 2.18 110.554 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.5 tttt -68.19 -34.24 75.93 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.068 -0.253 . . . . 1.0 110.936 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 52.3 mm-40 -75.25 -29.27 60.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.467 0.651 . . . . 2.27 109.675 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.94 -40.34 83.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.511 -0.768 . . . . 0.98 109.232 174.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.46 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.5 t90 -65.39 -38.58 90.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.019 -0.992 . . . . 0.2 109.933 177.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 40.5 mmt180 -58.99 -41.06 86.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 2.82 110.372 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.5 m -73.73 -10.12 59.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.077 -0.51 . . . . 1.85 111.501 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 16.8 t -74.75 -13.65 60.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.975 0.417 . . . . 1.68 110.512 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.687 -0.673 . . . . 2.17 110.358 178.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 N--CA 1.479 0.629 0 N-CA-C 110.635 -0.563 . . . . 2.13 110.635 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 51.1 m -114.66 53.29 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.397 0.618 . . . . 2.35 110.7 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.479 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 69.09 63.96 3.21 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.303 -0.862 . . . . 1.67 113.889 176.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -165.22 -65.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 117.098 0.449 . . . . 1.96 111.025 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 12.8 m -56.41 -45.73 80.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 1.47 111.096 -175.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 CA-C-N 116.359 -0.382 . . . . 1.03 110.856 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 19.4 t -69.22 -20.16 24.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.457 0.646 . . . . 1.08 110.018 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.418 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -89.0 11.63 17.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.898 -0.592 . . . . 0.9 111.458 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 49.1 p -106.51 158.56 16.83 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.601 -0.44 . . . . 1.07 110.764 -175.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.04 -39.14 89.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.863 -0.608 . . . . 2.46 109.615 175.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.97 -38.45 76.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.131 -0.94 . . . . 1.07 112.292 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.25 -51.31 66.71 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.749 -0.381 . . . . 0.31 110.348 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.09 -29.13 66.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.803 -0.635 . . . . 0.19 111.505 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -64.14 -52.02 61.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.135 -0.484 . . . . 1.23 110.413 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -71.61 -32.39 67.96 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 1.37 111.09 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.72 -46.75 86.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.171 -0.677 . . . . 1.03 109.171 175.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.27 -37.31 86.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.75 110.601 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.7 -39.52 95.35 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.938 -0.649 . . . . 0.18 112.142 176.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -66.14 -40.25 90.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.473 0.654 . . . . 2.18 109.294 177.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.9 mp -64.53 -34.28 77.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.07 -0.968 . . . . 1.07 110.487 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.66 -45.93 84.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.738 0.304 . . . . 1.13 110.419 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.6 mt-30 -58.93 -47.54 84.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 1.58 111.831 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.63 -45.41 17.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.236 -0.438 . . . . 2.61 112.136 -174.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.553 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.8 mp -82.16 -23.01 35.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 1.14 112.004 -172.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 56.81 37.24 28.67 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 123.969 0.793 . . . . 2.74 110.427 -176.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -156.47 110.3 2.71 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.566 -0.743 . . . . 1.12 109.8 -177.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.78 -34.16 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 2.32 111.222 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.27 -50.83 64.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.417 -0.356 . . . . 2.01 111.25 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.75 -27.95 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.422 . . . . 1.48 110.02 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.49 -37.21 84.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.493 0.663 . . . . 1.03 109.526 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.443 ' O ' HG21 ' A' ' 220' ' ' VAL . 2.8 t-20 -70.21 -46.63 64.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.274 -0.876 . . . . 0.63 110.121 178.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -58.27 -39.7 79.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.729 -0.669 . . . . 2.45 111.077 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . 0.457 HD12 HD21 ' A' ' 209' ' ' LEU . 33.5 mt -73.67 -36.29 65.31 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.183 -0.462 . . . . 1.08 110.653 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -57.66 -43.62 85.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.171 0.51 . . . . 1.49 110.007 177.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.591 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 58.8 t -71.38 -49.29 48.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.401 -0.818 . . . . 1.13 109.764 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . 0.491 HD21 ' O ' ' B' ' 225' ' ' ALA . 56.6 tp -57.14 -48.2 79.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.867 -1.06 . . . . 1.09 110.994 -177.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.39 -37.42 86.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.598 -0.728 . . . . 2.18 110.409 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.9 tttt -66.25 -33.64 76.21 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.836 -0.346 . . . . 1.0 110.726 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.71 64.7 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.521 -0.548 . . . . 2.28 109.521 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . 0.458 ' O ' HD21 ' B' ' 221' ' ' LEU . . . -68.29 -42.17 79.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.374 -0.83 . . . . 0.99 109.672 176.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.418 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -63.69 -39.03 93.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.276 -0.875 . . . . 0.21 110.131 177.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.6 mmm180 -64.12 -34.4 77.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.312 -0.403 . . . . 2.82 110.351 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -77.37 -7.35 55.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.526 -0.306 . . . . 1.85 111.032 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 32.4 t -75.21 -17.16 60.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.53 0.681 . . . . 1.67 109.563 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.413 -0.803 . . . . 2.18 109.684 176.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.477 0.516 0 N-CA-C 110.483 -0.622 . . . . 2.12 110.483 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 50.1 m -114.51 52.88 0.82 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.484 0.659 . . . . 2.33 110.816 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.463 ' HA2' ' HG ' ' A' ' 209' ' ' LEU . . . 69.28 63.77 3.27 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.197 -0.911 . . . . 1.68 113.874 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -164.99 -65.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.084 0.442 . . . . 1.97 111.111 177.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 11.4 m -56.8 -45.5 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.06 -0.518 . . . . 1.46 111.146 -175.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.64 -36.37 77.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.368 -0.378 . . . . 1.03 110.816 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.98 -20.37 24.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.529 0.68 . . . . 1.07 110.002 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.429 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -89.05 11.54 18.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.876 -0.602 . . . . 0.9 111.52 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 50.1 p -106.52 158.65 16.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.93 0.395 . . . . 1.06 110.577 -175.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -65.97 -39.27 90.24 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.497 -0.557 . . . . 2.46 109.497 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.86 -38.65 76.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.157 -0.928 . . . . 1.07 112.36 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -63.33 -51.2 66.97 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.714 -0.394 . . . . 0.31 110.332 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -70.09 -29.07 65.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.926 -0.579 . . . . 0.18 111.502 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.21 -52.11 60.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.458 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -71.66 -32.28 67.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.138 -0.483 . . . . 1.37 111.018 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.7 -46.69 86.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.255 -0.646 . . . . 1.03 109.255 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.26 -37.19 86.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.856 -0.611 . . . . 0.76 110.618 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.0 -39.1 95.21 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.994 -0.622 . . . . 0.18 112.163 176.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -66.4 -40.26 89.52 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.535 0.683 . . . . 2.18 109.4 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.8 mp -64.68 -34.27 77.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.106 -0.952 . . . . 1.07 110.516 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.49 -46.24 83.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.772 0.32 . . . . 1.14 110.271 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 53.4 mt-30 -58.9 -47.37 85.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.554 . . . . 1.58 111.8 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.77 -45.4 17.06 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.163 0.431 . . . . 2.62 112.163 -174.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.7 mp -82.14 -22.97 35.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.259 -0.428 . . . . 1.14 112.045 -172.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.78 37.45 28.81 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.987 0.804 . . . . 2.74 110.398 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -156.71 109.92 2.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.472 -0.786 . . . . 1.11 109.845 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -67.53 -34.23 76.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.012 -0.54 . . . . 2.31 111.285 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.22 -50.93 63.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.51 -0.314 . . . . 2.0 111.098 -176.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -70.81 -27.76 64.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.019 0.438 . . . . 1.48 110.049 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.56 -37.26 84.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.583 0.706 . . . . 1.04 109.594 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.446 ' O ' HG21 ' B' ' 220' ' ' VAL . 2.9 t-20 -70.08 -46.86 64.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.185 -0.916 . . . . 0.63 110.124 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -57.85 -40.15 79.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.714 -0.676 . . . . 2.43 111.116 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . 0.463 HD12 HD21 ' B' ' 209' ' ' LEU . 32.9 mt -73.4 -36.3 66.0 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.179 -0.464 . . . . 1.08 110.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -57.73 -43.49 85.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.152 0.501 . . . . 1.49 110.06 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 60.5 t -71.43 -49.33 47.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.457 -0.792 . . . . 1.12 109.798 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . 0.458 HD21 ' O ' ' A' ' 225' ' ' ALA . 56.7 tp -56.98 -48.16 79.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.968 -1.014 . . . . 1.09 111.061 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.5 -37.56 87.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.581 -0.736 . . . . 2.18 110.235 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.0 tttt -65.99 -33.84 76.72 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.86 -0.336 . . . . 1.0 110.707 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.63 64.65 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.556 -0.535 . . . . 2.27 109.556 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . 0.491 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -68.38 -42.19 79.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.394 -0.821 . . . . 0.98 109.602 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.429 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.8 t90 -63.68 -38.93 92.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.285 -0.87 . . . . 0.2 110.249 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.5 mmm180 -64.24 -34.43 78.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 2.82 110.397 176.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.1 t -77.48 -6.86 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.444 -0.344 . . . . 1.85 111.147 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 31.6 t -75.52 -16.9 60.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.452 -0.573 . . . . 1.68 109.452 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.419 -0.801 . . . . 2.17 109.966 176.98 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo . . . . . 0 N--CA 1.48 0.694 0 N-CA-C 110.411 -0.65 . . . . 2.13 110.411 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.2 m -127.88 61.12 1.43 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.298 0.571 . . . . 2.35 110.341 177.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.436 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 65.48 62.07 5.14 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.412 -0.813 . . . . 1.67 114.377 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -164.29 -72.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 117.152 0.476 . . . . 1.96 110.96 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 26.4 t -51.23 -47.62 62.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.408 -0.36 . . . . 1.47 111.637 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.6 -33.16 58.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.553 0.216 . . . . 1.03 111.122 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.421 HG11 ' CE2' ' A' ' 197' ' ' PHE . 44.0 t -69.14 -22.55 26.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.405 0.622 . . . . 1.08 110.183 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -86.16 12.36 9.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.837 -0.62 . . . . 0.9 111.756 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 36.9 p -108.43 155.32 20.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.013 0.435 . . . . 1.07 110.844 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -65.37 -32.97 74.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.75 -0.659 . . . . 2.46 109.262 174.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.01 -41.88 88.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.035 -0.984 . . . . 1.07 111.982 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . 0.438 ' CE1' HD13 ' B' ' 209' ' ' LEU . 54.2 t80 -64.3 -50.35 68.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.726 -0.39 . . . . 0.31 110.557 -179.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.1 -28.5 66.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.071 -0.513 . . . . 0.19 110.97 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -63.74 -49.7 72.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.998 -0.547 . . . . 1.23 110.433 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -70.94 -34.09 71.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.207 -0.452 . . . . 1.37 110.929 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . 0.412 ' O ' HD11 ' A' ' 205' ' ' LEU . 2.9 tm? -60.21 -48.04 83.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.957 -0.565 . . . . 1.03 109.739 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.437 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 47.1 tt0 -68.8 -34.7 75.96 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.677 -0.409 . . . . 0.75 110.364 176.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.09 95.41 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.18 111.773 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -67.62 -38.39 83.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.702 -0.481 . . . . 2.18 109.702 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 4.9 mp -66.03 -37.35 85.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.832 -0.622 . . . . 1.07 110.608 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -64.09 -47.36 80.35 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.713 0.292 . . . . 1.13 110.552 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -66.85 -43.23 84.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.177 -0.465 . . . . 1.58 111.77 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 8.7 tpt85 -75.15 -48.44 23.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.915 0.388 . . . . 2.61 111.308 -175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -77.24 -22.07 52.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.912 -0.585 . . . . 1.14 112.172 -176.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 63.11 32.46 15.21 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 124.131 0.895 . . . . 2.74 110.509 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.17 118.69 4.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 1.12 110.426 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -67.96 -40.06 83.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 2.32 112.085 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -62.2 -51.37 68.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.591 -0.277 . . . . 2.01 111.16 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 10.0 tp10 -70.73 -28.26 64.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.358 -0.383 . . . . 1.48 110.462 -177.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.58 -40.86 84.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.423 0.63 . . . . 1.03 109.975 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.419 ' O ' HG22 ' A' ' 220' ' ' VAL . 4.2 t-20 -69.05 -45.53 70.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.122 -0.944 . . . . 0.63 109.78 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.55 -40.49 87.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.364 -0.835 . . . . 2.45 111.149 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . 0.432 HD13 HD22 ' A' ' 209' ' ' LEU . 45.6 mt -72.77 -36.87 67.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.406 -0.361 . . . . 1.08 110.238 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . 0.437 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 40.6 ttp180 -56.43 -42.13 77.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.213 0.53 . . . . 1.49 110.172 175.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.586 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 99.5 t -71.33 -49.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.665 -0.698 . . . . 1.13 109.925 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 50.2 tp -56.63 -49.7 74.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.922 -1.036 . . . . 1.09 111.095 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -64.61 -36.93 85.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.224 -0.898 . . . . 2.18 110.491 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -68.57 -29.87 68.52 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.739 -0.384 . . . . 1.0 111.018 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.586 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 48.6 mt-10 -73.23 -33.78 65.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.311 -0.626 . . . . 2.28 109.311 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.82 -40.29 79.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.41 -0.813 . . . . 0.99 109.835 177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 58.1 t90 -65.13 -41.94 94.35 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.126 -0.943 . . . . 0.21 110.148 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -63.97 -37.98 89.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.043 -0.526 . . . . 2.82 111.089 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 43.4 m -73.71 -5.22 39.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.768 0.318 . . . . 1.85 111.641 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 64.0 m -85.75 -9.46 57.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.181 0.515 . . . . 1.67 110.412 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.685 -0.674 . . . . 2.18 109.748 176.901 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo . . . . . 0 N--CA 1.479 0.635 0 N-CA-C 110.26 -0.708 . . . . 2.12 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 21.9 m -127.81 60.9 1.43 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.34 0.591 . . . . 2.33 110.372 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.518 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 65.62 62.23 4.98 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.37 -0.832 . . . . 1.68 114.323 177.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -164.32 -72.21 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.145 0.472 . . . . 1.97 110.963 172.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 25.9 t -51.08 -47.81 61.77 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.289 0.368 . . . . 1.46 111.632 -177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.53 -32.95 57.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.657 0.265 . . . . 1.03 111.092 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . 0.418 HG11 ' CE2' ' B' ' 197' ' ' PHE . 43.6 t -69.24 -22.64 26.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.264 0.554 . . . . 1.07 110.256 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.41 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.29 12.14 10.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.867 -0.606 . . . . 0.9 111.625 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 35.8 p -108.15 155.31 20.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.917 0.389 . . . . 1.06 110.753 -175.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.38 -32.99 74.92 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.238 -0.653 . . . . 2.46 109.238 174.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.98 88.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.141 -0.936 . . . . 1.07 111.83 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . 0.486 ' CE1' HD13 ' A' ' 209' ' ' LEU . 54.4 t80 -64.18 -50.43 68.15 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.658 -0.417 . . . . 0.31 110.565 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.13 -28.36 66.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.1 -0.5 . . . . 0.18 110.972 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -63.76 -49.86 71.34 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 1.25 110.481 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.84 -34.02 71.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.284 -0.417 . . . . 1.37 110.867 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . 0.416 ' O ' HD11 ' B' ' 205' ' ' LEU . 2.9 tm? -60.15 -48.01 83.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 1.03 109.726 177.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.464 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 47.3 tt0 -68.81 -35.09 76.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.407 -0.36 . . . . 0.76 110.399 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -57.95 -41.97 94.58 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.827 -0.701 . . . . 0.18 111.742 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.96 -38.04 82.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.722 -0.473 . . . . 2.18 109.722 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.541 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 4.9 mp -66.44 -37.17 84.58 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.862 -0.608 . . . . 1.07 110.652 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -63.96 -47.81 78.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.781 0.324 . . . . 1.14 110.532 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -66.43 -43.22 86.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 1.58 111.878 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -75.18 -48.45 23.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.831 0.348 . . . . 2.62 111.295 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.9 mp -77.34 -21.88 52.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.98 -0.555 . . . . 1.14 112.171 -176.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 62.85 32.48 15.8 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 124.135 0.897 . . . . 2.74 110.593 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -155.15 118.57 4.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 1.11 110.285 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.86 -40.07 83.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.953 -0.567 . . . . 2.31 112.069 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -62.23 -51.13 69.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.648 0.261 . . . . 2.0 111.191 -174.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 9.2 tp10 -71.01 -28.17 64.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.886 0.374 . . . . 1.48 110.422 -177.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.54 -41.01 84.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.506 0.669 . . . . 1.04 109.958 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.418 ' O ' HG22 ' B' ' 220' ' ' VAL . 4.4 t-20 -69.13 -45.55 69.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.095 -0.957 . . . . 0.63 109.757 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.39 -40.42 86.54 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.404 -0.816 . . . . 2.43 111.245 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . 0.417 HD13 HD22 ' B' ' 209' ' ' LEU . 45.5 mt -72.79 -36.87 67.68 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.336 -0.393 . . . . 1.08 110.284 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . 0.464 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 40.8 ttp180 -56.46 -42.21 77.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.18 0.514 . . . . 1.49 110.125 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.578 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 97.2 t -71.28 -49.66 46.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.634 -0.712 . . . . 1.12 109.969 -178.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 50.0 tp -56.62 -49.43 75.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.908 -1.042 . . . . 1.09 111.115 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -64.8 -37.3 87.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.201 -0.909 . . . . 2.18 110.324 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -68.3 -30.06 68.96 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.758 -0.377 . . . . 1.0 110.908 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 48.3 mt-10 -73.22 -33.24 65.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.415 -0.587 . . . . 2.27 109.415 178.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.17 77.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.399 -0.818 . . . . 0.98 109.701 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.41 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 58.4 t90 -65.32 -41.85 93.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.06 -0.973 . . . . 0.2 110.187 177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -64.13 -37.81 88.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.53 . . . . 2.82 111.146 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 43.8 m -73.99 -4.74 37.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.508 -0.314 . . . . 1.85 111.693 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 66.3 m -85.88 -9.79 56.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.118 0.485 . . . . 1.68 110.426 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.553 -0.737 . . . . 2.17 109.917 177.05 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.476 0.486 0 N-CA-C 110.418 -0.647 . . . . 2.13 110.418 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 8.2 p -94.23 -4.19 49.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.945 0.403 . . . . 2.35 111.617 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' GLY . . . . . 0.497 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 96.22 73.63 1.17 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.676 -0.773 . . . . 1.67 113.716 173.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -171.68 -59.07 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.995 -0.372 . . . . 1.96 109.995 173.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.9 t -58.21 -40.15 80.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.106 -0.497 . . . . 1.47 110.65 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.0 p -70.59 -33.92 55.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-O 120.82 0.343 . . . . 1.03 110.78 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' VAL . . . . . 0.44 HG11 ' CE2' ' A' ' 197' ' ' PHE . 39.0 t -71.48 -19.75 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.704 0.764 . . . . 1.08 109.679 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' ALA . . . . . 0.475 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.14 11.59 11.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.468 -0.787 . . . . 0.9 111.466 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.9 p -106.02 151.22 24.92 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.049 0.452 . . . . 1.07 110.193 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -65.76 -32.9 74.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.7 -0.682 . . . . 2.46 109.304 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.55 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.925 -1.034 . . . . 1.07 111.782 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' PHE . . . . . 0.44 ' CE2' HG11 ' A' ' 192' ' ' VAL . 57.1 t80 -62.22 -50.23 72.59 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.737 0.303 . . . . 0.31 110.244 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -68.75 -28.86 67.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.785 -0.643 . . . . 0.19 111.51 -177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.94 -47.82 73.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.68 0.276 . . . . 1.23 110.386 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -66.64 -37.44 84.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.956 0.407 . . . . 1.37 110.598 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.89 -47.69 84.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.757 . . . . 1.03 109.867 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' GLN . . . . . 0.546 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 53.1 tt0 -69.04 -31.88 70.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.341 -0.391 . . . . 0.75 110.478 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.78 -41.34 99.61 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.18 111.509 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.0 -37.84 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.68 -0.489 . . . . 2.18 109.68 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.0 mp -66.78 -35.97 81.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.676 -0.693 . . . . 1.07 110.793 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.02 -46.95 82.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.77 0.319 . . . . 1.13 110.677 176.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -66.62 -41.46 88.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.094 -0.503 . . . . 1.58 111.768 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.0 tpt85 -74.69 -48.99 22.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.893 0.377 . . . . 2.61 111.387 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -80.73 -22.58 40.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.659 0.614 . . . . 1.14 112.659 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 14.4 mptt 62.99 35.09 13.46 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.679 0.612 . . . . 2.74 110.626 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -156.61 118.95 3.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.058 0.456 . . . . 1.12 110.592 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -67.97 -40.12 83.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.511 -0.768 . . . . 2.32 111.818 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 217' ' ' LYS . 6.5 m-20 -62.46 -51.34 67.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.377 . . . . 2.01 111.307 -173.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 23.4 tp10 -70.81 -31.06 67.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.919 0.39 . . . . 1.48 110.313 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.61 -39.44 91.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 1.03 110.132 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' ASN . . . . . 0.455 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -70.29 -47.36 61.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.63 110.1 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 213' ' ' ASP . 68.0 mttm -60.91 -37.01 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.775 -0.648 . . . . 2.45 111.094 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 44.4 mt -72.48 -39.97 67.28 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.306 -0.407 . . . . 1.08 110.271 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' ARG . . . . . 0.546 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 37.2 ttp180 -55.16 -42.31 72.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.142 0.496 . . . . 1.49 110.288 176.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' VAL . . . . . 0.632 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 85.9 t -71.13 -49.56 47.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.558 -0.746 . . . . 1.13 109.851 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.89 -48.5 78.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.937 -1.029 . . . . 1.09 111.025 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.14 -36.96 85.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 2.18 110.317 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -67.46 -31.73 72.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 1.0 110.846 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.632 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 44.3 mt-10 -75.42 -31.48 60.39 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.466 -0.568 . . . . 2.28 109.466 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.15 -41.63 77.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.428 -0.806 . . . . 0.99 109.662 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' TRP . . . . . 0.475 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 56.0 t90 -64.38 -37.74 88.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.165 -0.925 . . . . 0.21 110.1 177.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.77 -35.0 79.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.227 -0.442 . . . . 2.82 110.756 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 19.7 t -74.95 -9.68 58.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.938 0.399 . . . . 1.85 110.923 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 23.2 t -75.42 -12.51 60.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.166 0.508 . . . . 1.67 110.229 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.651 -0.69 . . . . 2.18 110.327 178.773 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.476 0.497 0 N-CA-C 110.379 -0.662 . . . . 2.12 110.379 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 7.7 p -94.15 -4.29 49.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.831 0.348 . . . . 2.33 111.716 177.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 96.14 73.68 1.18 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.676 -0.773 . . . . 1.68 113.556 173.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -171.3 -59.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.851 0.358 . . . . 1.97 110.045 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -39.99 80.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.46 110.721 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.59 -34.18 56.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 CA-C-O 120.864 0.364 . . . . 1.03 110.809 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' VAL . . . . . 0.442 HG11 ' CE2' ' B' ' 197' ' ' PHE . 39.1 t -71.38 -19.63 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.688 0.756 . . . . 1.07 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' ALA . . . . . 0.478 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.15 11.57 11.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.431 -0.804 . . . . 0.9 111.642 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.6 p -106.05 151.35 24.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.022 0.439 . . . . 1.06 110.165 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.99 -32.88 74.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.637 -0.71 . . . . 2.46 109.245 175.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.68 92.76 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.873 -1.058 . . . . 1.07 111.691 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' PHE . . . . . 0.442 ' CE2' HG11 ' B' ' 192' ' ' VAL . 56.0 t80 -62.25 -50.26 72.44 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.894 0.378 . . . . 0.31 110.093 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.7 -28.91 67.26 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.624 -0.716 . . . . 0.18 111.558 -177.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.88 -47.9 73.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.722 0.296 . . . . 1.25 110.38 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -66.39 -37.71 85.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.995 0.426 . . . . 1.37 110.387 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.74 -47.8 84.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.655 -0.702 . . . . 1.03 109.931 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.54 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 53.6 tt0 -68.95 -31.81 70.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.369 -0.378 . . . . 0.76 110.5 178.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.82 -41.45 99.63 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.749 -0.739 . . . . 0.18 111.512 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.8 -38.0 85.64 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.691 -0.485 . . . . 2.18 109.691 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.0 mp -66.63 -36.03 81.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.737 -0.665 . . . . 1.07 110.806 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -64.03 -46.76 83.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.82 0.343 . . . . 1.14 110.6 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.8 -41.25 87.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 1.58 111.926 -178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -74.87 -49.11 21.59 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.833 0.349 . . . . 2.62 111.292 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.0 mp -80.67 -22.66 40.24 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.524 0.564 . . . . 1.14 112.524 -175.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 14.3 mptt 62.95 34.98 13.66 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.658 0.599 . . . . 2.74 110.717 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -156.56 118.86 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.076 0.465 . . . . 1.11 110.536 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -67.97 -40.26 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.551 -0.749 . . . . 2.31 111.866 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.12 -51.44 67.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 2.0 111.34 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 22.0 tp10 -70.8 -31.04 67.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.923 0.392 . . . . 1.48 110.274 -178.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.69 -39.4 91.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.412 0.625 . . . . 1.04 110.025 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' ASN . . . . . 0.46 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.3 t-20 -70.25 -47.45 61.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.208 -0.905 . . . . 0.63 110.099 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.9 -37.04 80.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.77 -0.65 . . . . 2.43 111.013 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.1 mt -72.43 -40.01 67.42 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.325 -0.398 . . . . 1.08 110.203 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 219' ' ' ARG . . . . . 0.54 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 36.9 ttp180 -55.14 -42.18 72.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.088 0.47 . . . . 1.49 110.299 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 220' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 79.0 t -71.27 -49.59 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 1.12 109.816 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 60.7 tp -56.73 -48.73 77.11 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.961 -1.018 . . . . 1.09 111.039 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.01 -37.01 86.23 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.462 -0.79 . . . . 2.18 110.291 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.32 -31.96 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.012 -0.275 . . . . 1.0 110.801 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 224' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 43.8 mt-10 -75.21 -31.65 60.95 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.525 -0.546 . . . . 2.27 109.525 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.87 -41.68 78.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.523 -0.762 . . . . 0.98 109.65 175.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 226' ' ' TRP . . . . . 0.478 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 56.3 t90 -64.39 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.251 -0.886 . . . . 0.2 110.132 177.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.9 -34.87 78.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 2.82 110.658 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 24.2 t -74.63 -10.26 59.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.8 0.333 . . . . 1.85 110.891 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.1 t -75.24 -12.56 60.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.181 0.515 . . . . 1.68 110.371 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.636 -0.697 . . . . 2.17 110.467 178.667 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.542 0.211 . . . . 1.24 110.954 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.29 -33.92 47.65 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-O 120.779 0.323 . . . . 0.34999999999999998 110.377 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.476 HG22 HD11 ' B' ' 209' ' ' LEU . 22.3 t -69.89 -19.69 22.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.678 0.751 . . . . 0.23999999999999999 109.73 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.515 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.21 12.04 10.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.546 -0.752 . . . . 0.23999999999999999 111.522 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 34.1 p -108.98 146.28 34.12 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.485 0.66 . . . . 0.26000000000000001 110.562 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.95 -31.57 72.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 2.46 110.012 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.18 -40.5 94.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.4 -0.818 . . . . 0.26000000000000001 111.427 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.14 -49.98 73.69 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.338 -0.392 . . . . 0.22 109.943 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.82 -29.22 67.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.61 -0.723 . . . . 0.17000000000000001 111.845 -177.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.38 -48.3 70.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.799 0.333 . . . . 1.23 110.232 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.32 -33.84 73.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 1.3700000000000001 110.928 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.14 -47.13 86.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.921 -0.581 . . . . 0.17999999999999999 109.609 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.445 ' HB2' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.6 -32.19 72.76 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.438 -0.347 . . . . 0.70999999999999996 110.2 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.02 -41.7 96.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.959 -0.639 . . . . 0.16 111.735 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.14 -41.13 90.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.441 0.638 . . . . 1.26 109.534 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.425 HD23 ' HB2' ' A' ' 218' ' ' LEU . 3.0 mp -63.59 -37.93 89.21 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.094 -0.957 . . . . 0.19 110.434 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -66.76 -42.88 85.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.66 -0.245 . . . . 1.1299999999999999 110.664 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 49.7 mt-30 -57.51 -46.07 84.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.878 0.37 . . . . 1.1299999999999999 111.567 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.96 -41.32 20.97 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.484 0.55 . . . . 1.97 112.484 -175.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.47 HD11 HG22 ' B' ' 192' ' ' VAL . 8.3 mp -86.26 -22.46 26.83 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.049 0.389 . . . . 0.45000000000000001 112.049 -172.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.53 39.61 17.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.622 -0.717 . . . . 2.1899999999999999 110.991 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -157.99 117.33 3.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.955 0.407 . . . . 1.1200000000000001 110.221 -177.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.58 -44.29 82.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.569 -0.741 . . . . 1.4199999999999999 111.778 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -69.72 -40.67 76.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.532 -0.304 . . . . 2.0099999999999998 111.142 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -68.31 -40.21 81.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.329 0.585 . . . . 1.48 109.866 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.54 -32.71 74.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.403 -0.817 . . . . 0.20000000000000001 109.887 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 220' ' ' VAL . 65.4 t30 -69.76 -44.22 70.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.996 -1.002 . . . . 0.63 110.006 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -56.58 -42.65 79.03 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.389 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.425 ' HB2' HD23 ' A' ' 205' ' ' LEU . 53.7 mt -72.84 -35.18 67.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.656 -0.702 . . . . 0.20000000000000001 110.502 -177.043 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 219' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 202' ' ' GLN . 50.2 ttp180 -57.89 -42.99 85.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.03 0.443 . . . . 1.29 110.271 176.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 60.5 t -71.23 -49.08 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.639 -0.71 . . . . 0.19 109.806 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.409 HD21 ' O ' ' B' ' 225' ' ' ALA . 65.2 tp -57.36 -49.52 75.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.701 -1.136 . . . . 0.26000000000000001 110.964 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -66.3 -36.92 84.19 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.778 -0.647 . . . . 1.25 110.706 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 88.0 tttt -66.71 -34.54 78.08 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.67 -0.412 . . . . 0.35999999999999999 110.824 179.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 10.9 mm-40 -75.79 -30.49 59.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.135 0.493 . . . . 2.2799999999999998 109.822 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.37 -42.94 82.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.592 -0.731 . . . . 0.16 109.482 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 36.6 t90 -63.28 -36.2 82.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.121 -0.945 . . . . 0.19 110.096 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.572 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.7 82.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.263 -0.426 . . . . 2.25 110.626 175.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 14.5 t -76.61 -9.29 58.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.201 -0.454 . . . . 1.1599999999999999 110.785 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 35.1 t -75.19 -12.03 60.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.193 0.52 . . . . 0.93000000000000005 110.348 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.695 -0.669 . . . . 1.27 110.355 178.07 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.569 0.223 . . . . 1.24 110.834 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.13 -33.99 48.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 CA-C-O 120.721 0.296 . . . . 0.34000000000000002 110.269 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.47 HG22 HD11 ' A' ' 209' ' ' LEU . 22.2 t -69.82 -19.68 22.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.573 0.701 . . . . 0.23000000000000001 109.736 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.518 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.16 11.84 11.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.623 -0.717 . . . . 0.23000000000000001 111.486 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 34.4 p -108.87 146.17 34.15 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.572 0.701 . . . . 0.25 110.457 -175.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.79 -31.72 72.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.768 -1.105 . . . . 2.46 109.939 176.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.1 -40.29 93.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.518 -0.764 . . . . 0.27000000000000002 111.487 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.34 -50.1 72.97 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.332 -0.395 . . . . 0.22 109.991 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.71 -29.29 67.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.594 -0.73 . . . . 0.16 111.861 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.3 -48.48 70.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.8 0.333 . . . . 1.25 110.155 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.16 -33.95 74.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.378 -0.374 . . . . 1.3700000000000001 110.784 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -58.99 -47.16 86.18 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.003 -0.544 . . . . 0.17000000000000001 109.589 175.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.433 ' HB2' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.67 -32.07 72.48 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 116.459 -0.337 . . . . 0.70999999999999996 110.328 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.628 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.25 -41.55 96.83 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.968 -0.634 . . . . 0.16 111.594 175.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -66.21 -41.12 90.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.413 0.625 . . . . 1.26 109.509 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.415 HD23 ' HB2' ' B' ' 218' ' ' LEU . 3.0 mp -63.49 -38.06 89.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.108 -0.951 . . . . 0.20000000000000001 110.54 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -66.64 -43.16 85.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.672 -0.24 . . . . 1.1399999999999999 110.552 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.628 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 49.7 mt-30 -57.21 -46.13 83.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.429 -0.35 . . . . 1.1299999999999999 111.588 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -82.09 -41.17 20.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.425 0.528 . . . . 1.98 112.425 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.476 HD11 HG22 ' A' ' 192' ' ' VAL . 8.4 mp -86.26 -22.68 26.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.982 0.364 . . . . 0.45000000000000001 111.982 -172.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.45 40.07 17.63 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.909 0.756 . . . . 2.1899999999999999 110.758 -177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -158.2 117.37 3.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.888 0.375 . . . . 1.1100000000000001 110.319 -177.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -66.6 -44.28 82.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.604 -0.726 . . . . 1.4099999999999999 111.801 -177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.75 -41.05 75.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.445 -0.343 . . . . 2.0 111.045 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -67.98 -40.28 83.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.437 0.637 . . . . 1.48 110.002 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.8 74.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 0.20999999999999999 109.915 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.414 ' O ' HG23 ' B' ' 220' ' ' VAL . 65.2 t30 -69.56 -44.57 70.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.107 -0.952 . . . . 0.63 110.028 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -56.23 -42.93 78.08 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 116.137 -0.483 . . . . 1.97 110.377 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.415 ' HB2' HD23 ' B' ' 205' ' ' LEU . 54.2 mt -72.77 -35.04 67.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.689 -0.687 . . . . 0.20000000000000001 110.578 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 219' ' ' ARG . . . . . 0.433 ' HD3' ' HB2' ' B' ' 202' ' ' GLN . 50.1 ttp180 -57.83 -43.2 85.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.101 0.477 . . . . 1.29 110.18 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 59.6 t -71.16 -49.07 51.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.708 -0.678 . . . . 0.19 109.891 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.3 tp -57.23 -49.75 75.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.756 -1.111 . . . . 0.25 111.035 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -66.24 -36.79 83.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.76 -0.654 . . . . 1.24 110.731 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.557 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 87.9 tttt -66.84 -34.5 77.95 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.663 -0.415 . . . . 0.34999999999999998 110.795 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 12.0 mm-40 -75.75 -30.2 59.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.095 0.474 . . . . 2.27 109.796 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 225' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -67.64 -42.87 81.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.539 -0.755 . . . . 0.16 109.458 174.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.518 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 36.9 t90 -63.33 -36.23 82.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.207 -0.906 . . . . 0.19 110.151 176.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.99 82.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 2.25 110.386 175.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 19.5 t -76.36 -9.15 58.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.261 -0.427 . . . . 1.1799999999999999 110.871 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 33.5 t -75.35 -11.81 60.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.057 0.456 . . . . 0.93000000000000005 110.313 178.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.606 -0.711 . . . . 1.27 110.406 177.712 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 113.28 0.844 . . . . 1.24 113.28 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 14.8 p -86.74 -31.41 6.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.284 -0.567 . . . . 0.34999999999999998 111.009 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.461 HG22 HD11 ' B' ' 209' ' ' LEU . 28.1 t -68.28 -21.38 26.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.366 0.603 . . . . 0.23999999999999999 110.231 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.46 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.28 11.36 12.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.99 -0.55 . . . . 0.23999999999999999 111.354 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 46.1 p -106.32 145.66 31.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.279 0.561 . . . . 0.26000000000000001 109.998 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -65.45 -32.4 74.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.189 -0.914 . . . . 2.46 109.692 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.76 -37.87 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.366 -0.833 . . . . 0.26000000000000001 111.745 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -62.68 -50.8 69.72 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.967 -0.383 . . . . 0.22 109.967 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.18 -29.38 67.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.635 -0.711 . . . . 0.17000000000000001 111.553 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.88 -48.75 70.49 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.028 0.442 . . . . 1.23 110.316 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -72.45 -32.54 66.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 1.3700000000000001 110.938 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.46 -47.1 85.13 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.037 -0.727 . . . . 0.17999999999999999 109.037 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.46 ' HB2' ' HD2' ' A' ' 219' ' ' ARG . 49.8 tt0 -66.05 -33.84 76.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.145 -0.479 . . . . 0.70999999999999996 110.299 176.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.493 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -61.41 -39.82 97.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.829 -0.701 . . . . 0.16 112.068 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.45 -38.64 87.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.542 0.687 . . . . 1.26 109.258 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -65.55 -33.6 76.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.686 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.01 -43.63 87.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.869 0.366 . . . . 1.1299999999999999 110.476 175.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 51.4 mt-30 -59.99 -46.99 87.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.989 -0.551 . . . . 1.1299999999999999 111.532 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 208' ' ' ARG . 9.7 mmt180 -79.29 -47.02 16.6 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.431 0.53 . . . . 1.97 112.431 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.49 HD21 HD12 ' A' ' 218' ' ' LEU . 8.7 mp -81.87 -21.95 37.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.346 -0.388 . . . . 0.45000000000000001 111.858 -172.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.56 35.31 20.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 2.1899999999999999 110.658 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -157.93 118.79 3.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 1.1200000000000001 110.128 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -68.15 -37.4 81.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.625 -0.716 . . . . 1.4199999999999999 111.496 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.11 -50.12 62.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.236 -0.438 . . . . 2.0099999999999998 111.294 -175.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.71 -33.1 74.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.171 0.51 . . . . 1.48 109.925 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.4 87.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.531 0.682 . . . . 0.20000000000000001 110.115 178.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' ' 220' ' ' VAL . 63.3 t30 -69.68 -43.02 73.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.248 -0.887 . . . . 0.63 109.759 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.43 -37.8 84.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.566 -0.743 . . . . 1.99 111.215 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.49 HD12 HD21 ' A' ' 209' ' ' LEU . 32.5 mt -72.71 -36.34 67.8 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.829 -0.348 . . . . 0.20000000000000001 110.44 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 219' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 202' ' ' GLN . 64.4 ttt180 -57.25 -41.97 80.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.099 0.476 . . . . 1.29 110.358 175.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.4 t -70.45 -48.71 58.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.666 -0.697 . . . . 0.19 109.968 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.28 -48.71 80.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.995 -1.002 . . . . 0.26000000000000001 110.845 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.69 83.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.684 -0.689 . . . . 1.25 110.538 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.552 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.8 tttt -67.66 -33.89 75.85 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.705 -0.398 . . . . 0.35999999999999999 110.798 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 28.3 mm-40 -74.58 -30.64 61.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 2.2799999999999998 109.69 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.27 -41.35 85.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 0.16 109.411 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.46 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.0 t90 -65.11 -39.36 92.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.066 -0.97 . . . . 0.19 109.963 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.2 mmm180 -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.086 -0.506 . . . . 2.25 111.09 176.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.08 -4.62 36.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.148 0.499 . . . . 1.1599999999999999 110.972 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 24.3 t -80.22 -14.46 58.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.493 -0.558 . . . . 0.93000000000000005 109.493 176.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.717 -0.659 . . . . 1.27 110.048 177.631 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 113.239 0.829 . . . . 1.24 113.239 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 14.9 p -87.18 -31.45 5.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.238 -0.585 . . . . 0.34000000000000002 111.125 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.443 HG22 HD11 ' A' ' 209' ' ' LEU . 27.7 t -68.11 -21.37 26.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.498 0.666 . . . . 0.23000000000000001 110.381 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.52 11.67 12.11 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.907 -0.588 . . . . 0.23000000000000001 111.373 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 45.1 p -106.34 145.88 31.12 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.245 0.545 . . . . 0.25 110.019 -175.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.71 -32.3 73.78 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.136 -0.938 . . . . 2.46 109.678 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.93 84.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.349 -0.841 . . . . 0.27000000000000002 111.578 176.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.73 -50.75 69.87 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.902 -0.407 . . . . 0.22 109.902 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.12 -29.4 67.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.634 -0.712 . . . . 0.16 111.662 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -66.14 -48.52 70.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.04 0.448 . . . . 1.25 110.336 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -72.51 -32.57 66.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.226 -0.443 . . . . 1.3700000000000001 110.95 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 201' ' ' LEU . . . . . 0.401 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.9 tm? -58.51 -47.15 85.09 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.108 -0.701 . . . . 0.17000000000000001 109.108 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.474 ' HB2' ' HD2' ' B' ' 219' ' ' ARG . 50.0 tt0 -65.93 -34.03 77.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.70999999999999996 110.322 176.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.484 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -61.06 -40.37 98.42 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.827 -0.701 . . . . 0.16 112.051 176.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -66.0 -38.61 88.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.646 0.736 . . . . 1.26 109.2 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 2.9 mp -65.58 -33.57 76.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.936 -1.029 . . . . 0.20000000000000001 110.719 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.93 -44.23 85.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.837 0.351 . . . . 1.1399999999999999 110.411 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 50.2 mt-30 -59.48 -47.0 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.984 -0.553 . . . . 1.1299999999999999 111.636 179.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.38 -47.11 16.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.289 0.478 . . . . 1.98 112.289 -175.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.487 HD21 HD12 ' B' ' 218' ' ' LEU . 8.7 mp -81.65 -21.94 37.85 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.845 0.313 . . . . 0.45000000000000001 111.845 -172.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.28 35.6 20.78 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 124.098 0.874 . . . . 2.1899999999999999 110.574 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -158.06 118.71 3.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 1.1100000000000001 110.214 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -68.08 -37.54 81.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.665 -0.698 . . . . 1.4099999999999999 111.525 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.94 -49.93 63.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.199 -0.455 . . . . 2.0 111.326 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -68.03 -33.13 74.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 1.48 109.965 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.39 87.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 0.20999999999999999 110.095 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.482 ' O ' HG23 ' B' ' 220' ' ' VAL . 63.5 t30 -69.63 -43.14 73.3 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.372 -0.831 . . . . 0.63 109.792 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.38 -37.89 85.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.462 -0.79 . . . . 1.97 111.103 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.487 HD12 HD21 ' B' ' 209' ' ' LEU . 32.4 mt -72.59 -36.53 68.17 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.772 -0.371 . . . . 0.20000000000000001 110.348 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 219' ' ' ARG . . . . . 0.474 ' HD2' ' HB2' ' B' ' 202' ' ' GLN . 64.0 ttt180 -56.98 -42.08 79.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.064 0.459 . . . . 1.29 110.244 175.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 216' ' ' ASN . 80.1 t -70.48 -48.61 58.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.19 109.946 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.7 tp -59.46 -48.53 81.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.956 -1.02 . . . . 0.25 110.817 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.87 84.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.643 -0.708 . . . . 1.24 110.646 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.561 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.8 tttt -67.45 -34.12 76.55 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.799 -0.361 . . . . 0.34999999999999998 110.79 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 28.4 mm-40 -74.61 -30.55 61.72 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.223 0.535 . . . . 2.27 109.728 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.19 -41.26 86.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.483 -0.781 . . . . 0.16 109.452 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.6 t90 -65.14 -39.33 92.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.02 -0.991 . . . . 0.19 109.984 177.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.561 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.3 mmm180 -64.6 -40.16 95.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 2.25 111.075 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.2 t -74.06 -4.94 38.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.046 0.45 . . . . 1.1799999999999999 110.905 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.4 t -79.76 -14.85 58.42 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.65 -0.5 . . . . 0.93000000000000005 109.65 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.625 -0.702 . . . . 1.27 110.094 177.655 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 CA--C 1.529 0.171 0 N-CA-C 112.497 0.554 . . . . 1.24 112.497 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.585 HG11 ' HA ' ' B' ' 209' ' ' LEU . 7.5 p -75.29 -30.35 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.34999999999999998 110.812 -179.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 40.4 t -69.6 -20.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.565 0.698 . . . . 0.23999999999999999 109.701 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.431 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.33 10.95 13.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.574 -0.739 . . . . 0.23999999999999999 111.404 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 40.1 p -106.56 144.47 33.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.211 0.529 . . . . 0.26000000000000001 110.005 -175.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.93 -31.23 72.03 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.278 -0.874 . . . . 2.46 109.429 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.65 89.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.106 -0.952 . . . . 0.26000000000000001 111.247 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -61.71 -48.44 80.74 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.938 0.399 . . . . 0.22 109.971 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.78 -28.67 66.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.572 -0.74 . . . . 0.17000000000000001 111.664 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -66.37 -48.99 68.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.834 0.349 . . . . 1.23 110.358 174.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.36 -37.91 86.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.05 0.452 . . . . 1.3700000000000001 110.682 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.18 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.585 -0.734 . . . . 0.17999999999999999 109.735 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.447 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 60.9 tt0 -64.2 -36.75 85.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.025 -0.534 . . . . 0.70999999999999996 110.387 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.522 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.0 -41.79 98.07 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.034 -0.603 . . . . 0.16 112.069 177.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -66.56 -39.07 88.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.172 0.51 . . . . 1.26 109.637 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.5 mp -64.98 -34.15 77.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.565 -0.743 . . . . 0.19 110.539 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 206' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 47.3 mt-10 -65.97 -43.98 86.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.674 0.274 . . . . 1.1299999999999999 110.488 176.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 46.3 mt-30 -62.85 -48.81 77.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.433 . . . . 1.1299999999999999 111.691 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.8 tpt85 -77.87 -43.61 29.66 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.989 -0.551 . . . . 1.97 111.531 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.609 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 3.1 mp -84.25 -23.29 30.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.243 -0.435 . . . . 0.45000000000000001 112.16 -176.168 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.37 36.27 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.84 0.713 . . . . 2.1899999999999999 111.133 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -156.88 117.09 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.994 -0.548 . . . . 1.1200000000000001 110.266 -177.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -67.79 -37.19 81.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.684 -0.689 . . . . 1.4199999999999999 111.355 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -62.58 -50.18 72.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.318 -0.401 . . . . 2.0099999999999998 110.917 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.49 -37.62 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.972 -0.558 . . . . 1.48 110.005 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.11 -41.65 90.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.82 -0.627 . . . . 0.20000000000000001 110.618 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 220' ' ' VAL . 0.2 OUTLIER -70.87 -41.94 70.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.597 -0.728 . . . . 0.63 110.253 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -59.95 -43.07 95.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.013 -0.54 . . . . 1.99 110.684 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.426 HD12 HD21 ' A' ' 209' ' ' LEU . 63.1 mt -72.91 -34.86 66.88 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.744 -0.662 . . . . 0.20000000000000001 110.196 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -57.42 -44.32 84.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.134 0.492 . . . . 1.29 110.036 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 216' ' ' ASN . 73.4 t -71.68 -49.23 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.674 -0.694 . . . . 0.19 110.28 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.69 -48.68 80.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.028 -0.987 . . . . 0.26000000000000001 110.783 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -65.23 -38.85 91.69 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.649 -0.705 . . . . 1.25 110.585 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.3 tttt -65.75 -33.84 76.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.841 -0.343 . . . . 0.35999999999999999 110.866 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -76.97 -29.33 55.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.944 0.402 . . . . 2.2799999999999998 110.248 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.74 87.25 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.767 -0.652 . . . . 0.16 109.358 173.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.431 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.7 t90 -63.61 -37.1 86.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.061 -0.972 . . . . 0.19 109.965 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 37.1 mmt180 -62.34 -37.85 87.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.157 -0.474 . . . . 2.25 110.686 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 18.4 t -75.23 -10.05 59.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.308 -0.406 . . . . 1.1599999999999999 110.962 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.2 t -76.61 -7.35 55.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.037 0.446 . . . . 0.93000000000000005 109.89 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.708 -0.663 . . . . 1.27 109.894 175.867 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.462 0.139 0 N-CA-C 112.409 0.522 . . . . 1.24 112.409 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 191' ' ' VAL . . . . . 0.515 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.5 p -74.95 -30.68 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.794 0.331 . . . . 0.34000000000000002 110.868 -178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.48 -20.79 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.681 0.753 . . . . 0.23000000000000001 109.74 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.434 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.04 10.9 12.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.42 -0.809 . . . . 0.23000000000000001 111.551 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 41.5 p -106.75 144.3 33.6 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.216 0.531 . . . . 0.25 109.968 -175.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -65.86 -31.33 72.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.253 -0.885 . . . . 2.46 109.373 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.72 89.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.121 -0.945 . . . . 0.27000000000000002 111.356 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -61.63 -48.48 80.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.941 -0.392 . . . . 0.22 109.941 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.67 -28.59 67.01 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.666 -0.697 . . . . 0.16 111.707 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.44 -48.99 68.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.72 0.295 . . . . 1.25 110.385 174.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -66.31 -37.97 86.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.966 0.412 . . . . 1.3700000000000001 110.737 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.2 -47.0 86.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 0.17000000000000001 109.646 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 61.1 tt0 -63.85 -36.95 85.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.70999999999999996 110.459 177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.513 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.18 -41.74 98.32 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.104 -0.569 . . . . 0.16 111.996 177.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -66.48 -39.11 88.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.62 -0.511 . . . . 1.26 109.62 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.4 mp -64.96 -34.1 77.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.623 -0.717 . . . . 0.20000000000000001 110.434 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 206' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 45.2 mt-10 -66.22 -43.49 86.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.734 0.302 . . . . 1.1399999999999999 110.499 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 46.7 mt-30 -63.22 -48.92 76.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.019 0.437 . . . . 1.1299999999999999 111.808 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 3.9 tpt85 -77.81 -43.47 30.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.959 -0.564 . . . . 1.98 111.456 -173.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 2.9 mp -84.17 -23.51 30.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.227 -0.442 . . . . 0.45000000000000001 112.187 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.54 35.97 26.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.582 -0.735 . . . . 2.1899999999999999 111.131 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -156.5 117.41 3.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.005 -0.543 . . . . 1.1100000000000001 110.238 -177.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -67.85 -37.42 81.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.766 -0.652 . . . . 1.4099999999999999 111.367 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.45 -50.31 71.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 2.0 110.817 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.44 -37.37 87.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.084 -0.507 . . . . 1.48 109.957 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.32 -41.59 89.43 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.887 -0.597 . . . . 0.20999999999999999 110.644 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' B' ' 220' ' ' VAL . 0.2 OUTLIER -70.77 -42.28 70.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.665 -0.698 . . . . 0.63 110.184 -179.402 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -59.71 -43.07 94.27 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.97 110.67 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.411 HD12 HD21 ' B' ' 209' ' ' LEU . 63.3 mt -72.94 -34.75 66.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.85 -0.614 . . . . 0.20000000000000001 110.241 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -57.66 -44.28 85.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.06 0.457 . . . . 1.29 110.06 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 216' ' ' ASN . 66.7 t -71.54 -49.45 46.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.749 -0.659 . . . . 0.19 110.277 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.9 tp -58.3 -48.7 79.67 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.002 -0.999 . . . . 0.25 110.981 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -65.13 -38.93 92.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.668 -0.696 . . . . 1.24 110.577 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.2 tttt -65.56 -34.08 77.42 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.929 -0.309 . . . . 0.34999999999999998 110.926 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -76.92 -29.33 55.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.09 0.471 . . . . 2.27 110.096 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.47 -42.65 87.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.29 -0.633 . . . . 0.16 109.29 173.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.434 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 52.6 t90 -63.62 -37.08 85.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.995 -1.002 . . . . 0.19 110.017 176.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 37.0 mmt180 -62.37 -37.63 86.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 2.25 110.859 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.9 t -75.58 -9.95 59.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 1.1799999999999999 110.788 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 19.4 t -76.46 -7.84 55.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.172 0.51 . . . . 0.93000000000000005 110.054 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.652 -0.689 . . . . 1.27 109.849 175.893 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.458 -0.071 0 N-CA-C 112.102 0.408 . . . . 1.24 112.102 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.448 HG21 ' HG3' ' B' ' 208' ' ' ARG . 11.9 p -70.06 -32.85 52.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.773 -0.371 . . . . 0.34999999999999998 110.939 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 22.1 t -66.97 -19.85 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.69 0.757 . . . . 0.23999999999999999 109.749 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.458 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -90.04 12.2 18.41 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.613 -0.721 . . . . 0.23999999999999999 111.597 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 42.8 p -107.86 152.18 24.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.227 0.536 . . . . 0.26000000000000001 110.362 -176.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.51 -32.69 74.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.385 -0.825 . . . . 2.46 109.708 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.61 90.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.23 -0.896 . . . . 0.26000000000000001 111.863 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -62.35 -50.94 69.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.22 110.236 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -69.18 -28.27 66.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.705 -0.679 . . . . 0.17000000000000001 111.448 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.66 -51.98 65.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 1.23 110.509 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.65 -32.5 65.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.275 -0.42 . . . . 1.3700000000000001 111.371 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.86 -47.78 83.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.166 -0.679 . . . . 0.17999999999999999 109.166 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.2 tt0 -67.0 -33.18 75.0 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.925 -0.58 . . . . 0.70999999999999996 110.195 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.77 -40.12 97.7 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.928 -0.653 . . . . 0.16 111.906 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -67.16 -38.73 85.98 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.528 -0.545 . . . . 1.26 109.528 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.7 mp -66.19 -38.19 87.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.529 -0.76 . . . . 0.19 110.561 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 206' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.7 mt-10 -63.36 -48.54 77.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.362 . . . . 1.1299999999999999 110.863 176.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 95.9 mt-30 -66.24 -40.94 90.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.357 -0.383 . . . . 1.1299999999999999 112.011 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.467 ' HG3' HG21 ' B' ' 191' ' ' VAL . 5.0 tpt180 -77.75 -48.47 16.57 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.814 0.301 . . . . 1.97 111.814 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.1 mp -82.31 -23.34 35.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 0.45000000000000001 111.784 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 210' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 207' ' ' GLN . 33.9 mmtp 58.76 39.82 23.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.274 -0.875 . . . . 2.1899999999999999 110.487 -174.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -153.1 109.4 3.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.572 -0.74 . . . . 1.1200000000000001 109.812 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -67.61 -36.43 80.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.279 -0.419 . . . . 1.4199999999999999 111.497 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -64.05 -50.4 68.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.871 0.367 . . . . 2.0099999999999998 110.712 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.67 -29.86 66.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.095 -0.502 . . . . 1.48 110.29 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.35 85.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.547 0.689 . . . . 0.20000000000000001 109.752 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 220' ' ' VAL . 58.9 t30 -70.1 -46.25 65.25 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.066 -0.97 . . . . 0.63 110.318 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -59.07 -40.72 86.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 1.99 110.899 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.63 -36.89 68.14 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.003 -0.544 . . . . 0.20000000000000001 110.38 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -58.94 -42.55 90.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.926 0.393 . . . . 1.29 110.388 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.9 t -71.13 -44.63 74.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.924 -0.58 . . . . 0.19 109.707 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.0 tp -57.24 -50.86 71.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.891 -1.049 . . . . 0.26000000000000001 110.89 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.75 -37.14 81.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.212 -0.904 . . . . 1.25 110.591 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.7 tttt -66.09 -36.38 83.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.35999999999999999 110.68 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.192 0.52 . . . . 2.2799999999999998 110.042 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.17 -40.57 86.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.493 -0.776 . . . . 0.16 109.346 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.458 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 47.5 t90 -67.35 -39.81 85.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.063 -0.971 . . . . 0.19 110.366 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.609 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.6 mmm180 -61.32 -39.06 89.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.966 0.412 . . . . 2.25 110.467 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.06 -6.21 46.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 1.1599999999999999 111.131 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 65.8 m -84.52 -9.59 58.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.989 0.423 . . . . 0.93000000000000005 110.667 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.289 -0.862 . . . . 1.27 110.184 176.074 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.23 0.056 0 N-CA-C 111.959 0.355 . . . . 1.24 111.959 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 191' ' ' VAL . . . . . 0.467 HG21 ' HG3' ' A' ' 208' ' ' ARG . 12.1 p -70.18 -32.95 52.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 C-N-CA 120.961 -0.296 . . . . 0.34000000000000002 110.883 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 22.4 t -66.95 -19.88 26.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.619 0.723 . . . . 0.23000000000000001 109.747 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.464 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -90.1 12.37 17.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.613 -0.721 . . . . 0.23000000000000001 111.432 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.99 152.12 24.9 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.376 0.607 . . . . 0.25 110.355 -176.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.4 -32.65 74.16 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.295 -0.866 . . . . 2.46 109.826 176.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.75 90.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.331 -0.85 . . . . 0.27000000000000002 111.856 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -62.16 -51.08 69.28 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.22 110.196 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -69.1 -28.13 66.21 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.621 -0.718 . . . . 0.16 111.536 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.64 -51.96 65.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.851 0.358 . . . . 1.25 110.487 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.68 -32.52 65.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 1.3700000000000001 111.386 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.13 -47.58 84.76 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.194 -0.669 . . . . 0.17000000000000001 109.194 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.0 tt0 -66.99 -33.31 75.3 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.70999999999999996 110.252 176.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.75 -40.13 97.69 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 121.076 -0.583 . . . . 0.16 112.007 176.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -67.01 -38.73 86.47 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.566 -0.531 . . . . 1.26 109.566 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.6 mp -66.08 -38.38 88.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.433 -0.803 . . . . 0.20000000000000001 110.528 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 206' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.8 mt-10 -63.24 -48.81 76.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.841 0.353 . . . . 1.1399999999999999 110.801 176.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 95.8 mt-30 -66.09 -40.93 91.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.196 -0.456 . . . . 1.1299999999999999 111.971 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 208' ' ' ARG . . . . . 0.448 ' HG3' HG21 ' A' ' 191' ' ' VAL . 5.0 tpt180 -77.8 -48.53 16.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.753 0.311 . . . . 1.98 111.731 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.1 mp -82.38 -23.12 35.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.815 0.302 . . . . 0.45000000000000001 111.815 -175.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 210' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' B' ' 207' ' ' GLN . 33.9 mmtp 58.47 39.8 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.393 -0.822 . . . . 2.1899999999999999 110.484 -174.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.05 109.72 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.507 -0.769 . . . . 1.1100000000000001 109.736 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -67.55 -36.28 80.66 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.275 -0.421 . . . . 1.4099999999999999 111.49 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.33 -50.19 68.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.86 0.362 . . . . 2.0 110.804 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.78 -29.88 66.2 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.126 -0.488 . . . . 1.48 110.113 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.23 85.63 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.516 0.674 . . . . 0.20999999999999999 109.641 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.415 ' O ' HG23 ' B' ' 220' ' ' VAL . 58.1 t30 -70.22 -46.63 64.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.14 -0.936 . . . . 0.63 110.27 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -58.65 -40.79 84.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 1.97 110.912 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.71 -36.61 67.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.002 -0.544 . . . . 0.20000000000000001 110.364 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -59.04 -42.63 90.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.898 0.38 . . . . 1.29 110.367 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 216' ' ' ASN . 84.6 t -71.23 -44.6 73.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.42 0.628 . . . . 0.19 109.678 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.12 -50.73 71.89 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.945 -1.025 . . . . 0.25 110.915 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.99 -37.34 81.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 1.24 110.609 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.608 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.7 tttt -65.87 -36.38 83.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.505 -0.316 . . . . 0.34999999999999998 110.716 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.21 -31.64 64.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.133 0.492 . . . . 2.27 109.921 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.62 86.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.16 109.341 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.464 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 47.1 t90 -67.49 -39.57 85.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.029 -0.987 . . . . 0.19 110.283 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.2 mmm180 -61.29 -39.34 90.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 2.25 110.423 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.31 -5.56 42.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 1.1799999999999999 111.167 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 59.6 m -84.84 -9.81 57.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.045 0.45 . . . . 0.93000000000000005 110.64 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.579 -0.724 . . . . 1.27 110.189 175.979 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 111.895 0.331 . . . . 1.24 111.895 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 9.5 p -79.56 -25.8 12.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 C-N-CA 120.231 -0.587 . . . . 0.34999999999999998 110.034 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.433 HG22 HD11 ' B' ' 209' ' ' LEU . 51.2 t -69.05 -25.0 28.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.411 0.625 . . . . 0.23999999999999999 109.815 176.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -82.64 12.05 5.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.726 -0.67 . . . . 0.23999999999999999 111.842 -177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.03 153.01 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.918 0.389 . . . . 0.26000000000000001 110.487 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.97 -34.77 78.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.866 -0.606 . . . . 2.46 109.747 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.26 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.453 -0.794 . . . . 0.26000000000000001 111.829 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' PHE . . . . . 0.479 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 59.3 t80 -61.9 -51.13 69.41 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.824 0.345 . . . . 0.22 110.099 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 198' ' ' TRP . . . . . 0.429 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 97.2 m95 -69.02 -28.38 66.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.496 -0.775 . . . . 0.17000000000000001 111.54 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.17 -49.77 70.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.279 -0.418 . . . . 1.23 110.408 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.01 -33.7 70.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 1.3700000000000001 110.904 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.405 ' O ' HD13 ' A' ' 205' ' ' LEU . 1.7 tm? -59.49 -47.63 84.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.378 -0.601 . . . . 0.17999999999999999 109.378 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.5 tt0 -66.47 -33.47 75.76 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.089 -0.505 . . . . 0.70999999999999996 110.272 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.8 -41.28 99.08 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 121.049 -0.596 . . . . 0.16 111.929 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -66.95 -38.4 86.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 1.26 109.784 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.8 mp -65.22 -37.76 88.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.582 -0.735 . . . . 0.19 110.475 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 206' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 49.7 mt-10 -65.9 -45.41 82.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.567 -0.288 . . . . 1.1299999999999999 110.828 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.0 mt-30 -61.97 -48.29 81.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.931 0.396 . . . . 1.1299999999999999 111.459 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -72.75 -48.31 39.57 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.941 -0.572 . . . . 1.97 111.383 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.455 HD11 HG22 ' B' ' 192' ' ' VAL . 6.6 mp -83.13 -23.12 33.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.079 -0.509 . . . . 0.45000000000000001 111.352 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.56 39.97 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.222 -0.899 . . . . 2.1899999999999999 109.928 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.85 113.75 3.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.624 -0.716 . . . . 1.1200000000000001 110.434 -176.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -67.87 -33.85 75.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.853 -0.612 . . . . 1.4199999999999999 111.244 -177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.67 -51.11 61.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.449 . . . . 2.0099999999999998 111.026 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -68.82 -35.09 76.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 1.48 109.988 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.82 -39.34 87.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.738 -0.664 . . . . 0.20000000000000001 110.486 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' A' ' 220' ' ' VAL . 58.1 t30 -66.98 -48.31 68.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.57 -0.741 . . . . 0.63 110.311 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.99 -39.22 77.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.88 -0.6 . . . . 1.99 111.027 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 42.7 mt -72.66 -39.43 67.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.138 -0.483 . . . . 0.20000000000000001 110.9 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.26 -41.02 87.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.059 0.457 . . . . 1.29 110.179 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.464 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 87.3 t -70.24 -44.69 77.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.689 -0.687 . . . . 0.19 109.66 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.0 -49.89 76.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.98 -1.009 . . . . 0.26000000000000001 110.624 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -68.1 -38.56 82.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.329 -0.85 . . . . 1.25 110.852 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.8 tttt -67.11 -36.16 81.34 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.823 -0.351 . . . . 0.35999999999999999 110.821 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 47.3 mm-40 -75.38 -28.9 59.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.04 0.447 . . . . 2.2799999999999998 110.024 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.2 -40.04 82.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.65 -0.705 . . . . 0.16 109.301 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 51.5 t90 -64.7 -40.21 94.98 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.917 -1.038 . . . . 0.19 109.851 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.8 mmm180 -62.97 -39.99 96.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.997 -0.547 . . . . 2.25 110.661 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 25.9 t -73.48 -6.1 44.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 1.1599999999999999 111.116 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.0 t -79.28 -13.56 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.154 0.502 . . . . 0.93000000000000005 109.756 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.576 -0.726 . . . . 1.27 110.01 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 111.931 0.345 . . . . 1.24 111.931 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 191' ' ' VAL . . . . . 0.483 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 9.4 p -79.58 -25.71 12.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 120.262 -0.575 . . . . 0.34000000000000002 109.96 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.455 HG22 HD11 ' A' ' 209' ' ' LEU . 51.5 t -69.09 -25.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.423 0.63 . . . . 0.23000000000000001 109.8 176.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -82.38 11.82 5.12 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.763 -0.653 . . . . 0.23000000000000001 111.949 -177.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.01 153.07 23.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.967 0.413 . . . . 0.25 110.49 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.0 -34.59 78.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.756 -0.656 . . . . 2.46 109.823 176.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.79 84.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.343 -0.844 . . . . 0.27000000000000002 111.828 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 197' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -61.81 -51.14 69.49 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.22 110.134 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 198' ' ' TRP . . . . . 0.437 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 97.2 m95 -69.17 -28.31 66.29 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.511 -0.768 . . . . 0.16 111.453 -178.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.11 -49.8 70.79 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.232 -0.44 . . . . 1.25 110.473 174.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.12 -33.75 70.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 1.3700000000000001 110.864 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 201' ' ' LEU . . . . . 0.41 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.8 tm? -59.23 -47.88 83.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.326 -0.62 . . . . 0.17000000000000001 109.326 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.423 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.4 tt0 -66.25 -33.63 76.18 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.969 -0.56 . . . . 0.70999999999999996 110.349 176.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.67 -41.07 98.79 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.057 -0.592 . . . . 0.16 111.873 176.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -67.32 -38.37 84.82 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.668 -0.493 . . . . 1.26 109.668 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.9 mp -65.13 -37.69 88.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.755 . . . . 0.20000000000000001 110.55 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 206' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 49.3 mt-10 -65.77 -45.82 81.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.589 -0.278 . . . . 1.1399999999999999 110.873 177.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 52.9 mt-30 -61.74 -48.27 81.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 1.1299999999999999 111.375 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 208' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' B' ' 208' ' ' ARG . 4.4 tpt180 -72.66 -48.18 41.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.81 -0.632 . . . . 1.98 111.482 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.6 mp -83.43 -23.02 32.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.05 -0.523 . . . . 0.45000000000000001 111.496 -176.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' B' ' 210' ' ' LYS . 45.4 tptt 55.67 39.62 30.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.254 -0.885 . . . . 2.1899999999999999 109.928 -175.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.79 113.52 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.594 -0.73 . . . . 1.1100000000000001 110.32 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -67.84 -33.71 75.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.792 -0.64 . . . . 1.4099999999999999 111.22 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.8 -51.09 61.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.233 -0.44 . . . . 2.0 110.91 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.95 -35.09 76.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.858 -0.61 . . . . 1.48 109.957 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.31 87.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.759 -0.655 . . . . 0.20999999999999999 110.45 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.446 ' O ' HG23 ' B' ' 220' ' ' VAL . 57.4 t30 -66.93 -48.46 68.55 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.56 -0.745 . . . . 0.63 110.382 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.97 -39.04 77.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.917 -0.583 . . . . 1.97 111.011 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.413 HD11 HG21 ' A' ' 192' ' ' VAL . 42.6 mt -72.82 -39.46 66.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.207 -0.451 . . . . 0.20000000000000001 110.916 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.17 -41.15 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 1.29 110.236 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 90.1 t -70.24 -44.66 77.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.684 -0.689 . . . . 0.19 109.647 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 61.0 tp -59.06 -49.61 77.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.869 -1.059 . . . . 0.25 110.683 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -68.33 -38.35 81.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.428 -0.805 . . . . 1.24 110.869 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.9 tttt -67.2 -36.23 81.3 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.837 -0.345 . . . . 0.34999999999999998 110.89 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 49.7 mm-40 -75.34 -28.74 59.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 2.27 110.056 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.94 81.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.639 -0.71 . . . . 0.16 109.313 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.3 t90 -64.8 -40.05 94.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.846 -1.07 . . . . 0.19 109.854 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.7 mmm180 -63.12 -40.08 96.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.867 -0.606 . . . . 2.25 110.693 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.6 t -73.38 -5.84 42.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.858 0.361 . . . . 1.1799999999999999 111.108 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 20.9 t -79.35 -13.71 59.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.157 0.503 . . . . 0.93000000000000005 109.847 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.245 0.832 0 CA-C-O 118.58 -0.724 . . . . 1.27 110.142 177.513 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.946 0.403 . . . . 1.24 110.818 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 14.4 p -76.36 -30.36 19.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 116.236 -0.438 . . . . 0.34999999999999998 110.185 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.442 HG22 HD11 ' B' ' 209' ' ' LEU . 60.7 t -69.7 -23.68 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.545 0.688 . . . . 0.23999999999999999 109.614 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.24 12.43 5.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.477 -0.783 . . . . 0.23999999999999999 111.505 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.82 150.23 27.27 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.076 0.465 . . . . 0.26000000000000001 110.494 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.41 -34.14 77.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.417 -0.811 . . . . 2.46 109.844 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.0 -35.33 78.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.165 -0.925 . . . . 0.26000000000000001 111.809 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 58.9 t80 -63.87 -51.04 66.4 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.865 0.364 . . . . 0.22 110.123 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 198' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 93.9 m95 -68.11 -29.89 68.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 0.17000000000000001 111.255 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.9 -43.92 78.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.432 -0.349 . . . . 1.23 110.338 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -71.7 -35.85 70.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.212 0.53 . . . . 1.3700000000000001 109.75 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.65 -47.73 83.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.426 -0.806 . . . . 0.17999999999999999 109.348 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.507 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.62 -28.68 67.95 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.196 -0.457 . . . . 0.70999999999999996 110.204 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.27 -41.77 98.46 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.854 -0.689 . . . . 0.16 111.599 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -66.81 -38.24 86.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 1.26 109.87 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.1 mp -66.5 -40.03 89.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.754 -0.657 . . . . 0.19 110.698 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.13 -43.61 91.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.568 0.223 . . . . 1.1299999999999999 110.939 177.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.429 ' O ' ' HE2' ' A' ' 210' ' ' LYS . 49.4 mt-30 -60.8 -48.94 79.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.823 0.344 . . . . 1.1299999999999999 111.707 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.24 -43.49 51.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.153 -0.476 . . . . 1.97 111.55 -173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.459 HD11 HG22 ' B' ' 192' ' ' VAL . 7.9 mp -88.28 -23.71 23.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.218 -0.446 . . . . 0.45000000000000001 112.202 -174.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 210' ' ' LYS . . . . . 0.429 ' HE2' ' O ' ' A' ' 207' ' ' GLN . 75.5 mmtt 55.09 38.61 30.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.868 -0.605 . . . . 2.1899999999999999 110.679 -175.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -150.03 110.68 4.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 1.1200000000000001 109.351 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -65.29 -38.98 91.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.133 -0.485 . . . . 1.4199999999999999 111.46 -175.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.37 -50.42 69.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.264 -0.425 . . . . 2.0099999999999998 111.02 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.23 -35.1 75.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.002 0.43 . . . . 1.48 110.461 -177.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.47 89.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.359 0.6 . . . . 0.20000000000000001 110.203 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 2.7 t-20 -70.19 -45.38 66.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.164 -0.925 . . . . 0.63 109.904 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -58.0 -40.44 80.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.645 -0.707 . . . . 1.99 111.134 177.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.401 ' HB2' HD23 ' A' ' 205' ' ' LEU . 56.7 mt -72.47 -37.51 68.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.16 -0.473 . . . . 0.20000000000000001 110.455 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 219' ' ' ARG . . . . . 0.507 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 48.4 ttp180 -56.36 -41.44 76.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.103 0.478 . . . . 1.29 110.155 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.612 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 89.2 t -70.57 -49.1 54.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.509 -0.768 . . . . 0.19 109.901 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.76 -48.74 78.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.867 -1.061 . . . . 0.26000000000000001 110.829 -177.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -66.27 -38.32 87.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.61 -0.723 . . . . 1.25 110.524 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.2 tttt -64.4 -36.9 85.67 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.35999999999999999 110.81 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 51.9 mt-10 -73.96 -30.59 62.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 2.2799999999999998 109.735 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.5 -43.51 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.658 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -64.69 -39.96 94.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.19 110.08 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.8 mmm180 -63.21 -39.23 94.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 2.25 111.088 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 22.0 m -73.98 -5.01 38.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.499 -0.319 . . . . 1.1599999999999999 111.446 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 27.4 t -79.66 -11.53 59.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.281 0.562 . . . . 0.93000000000000005 109.749 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.435 -0.793 . . . . 1.27 110.205 178.231 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.911 0.386 . . . . 1.24 110.746 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 191' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 14.5 p -76.12 -30.16 20.15 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.372 -0.376 . . . . 0.34000000000000002 110.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.459 HG22 HD11 ' A' ' 209' ' ' LEU . 60.5 t -69.82 -23.45 25.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.541 0.686 . . . . 0.23000000000000001 109.585 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.51 12.25 5.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.543 -0.753 . . . . 0.23000000000000001 111.516 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 42.1 p -107.58 150.18 27.16 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.191 0.519 . . . . 0.25 110.446 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.41 -34.21 77.76 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.358 -0.837 . . . . 2.46 109.777 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.29 78.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.267 -0.878 . . . . 0.27000000000000002 111.798 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 197' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -63.79 -50.86 67.33 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 120.914 0.388 . . . . 0.22 110.207 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 198' ' ' TRP . . . . . 0.471 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 94.0 m95 -68.39 -29.86 68.65 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.756 -0.657 . . . . 0.16 111.238 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -67.81 -43.6 79.26 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.836 0.35 . . . . 1.25 110.557 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.0 -35.76 69.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.326 0.584 . . . . 1.3700000000000001 109.84 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.7 -47.71 83.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.17000000000000001 109.31 175.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.61 -28.81 68.06 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 116.157 -0.474 . . . . 0.70999999999999996 110.24 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.21 -41.63 98.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.793 -0.718 . . . . 0.16 111.623 174.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -66.9 -38.07 85.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.004 0.43 . . . . 1.26 109.856 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.2 mp -66.77 -40.01 88.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.724 -0.671 . . . . 0.20000000000000001 110.623 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.96 -43.73 91.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.805 -0.18 . . . . 1.1399999999999999 110.896 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.431 ' O ' ' HE2' ' B' ' 210' ' ' LYS . 49.2 mt-30 -61.25 -48.08 83.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 1.1299999999999999 111.882 177.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.62 -43.64 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.21 -0.45 . . . . 1.98 111.476 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.442 HD11 HG22 ' A' ' 192' ' ' VAL . 8.1 mp -88.2 -23.88 23.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.065 -0.516 . . . . 0.45000000000000001 112.085 -174.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' B' ' 207' ' ' GLN . 75.4 mmtt 55.4 38.31 30.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.753 -0.658 . . . . 2.1899999999999999 110.689 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -149.64 110.76 4.38 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.701 -0.682 . . . . 1.1100000000000001 109.476 -176.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -64.98 -39.13 93.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 1.4099999999999999 111.611 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -63.33 -50.5 69.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.388 -0.369 . . . . 2.0 111.089 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -69.3 -35.1 75.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 1.48 110.362 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.04 -39.56 90.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.20999999999999999 110.209 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' B' ' 220' ' ' VAL . 2.7 t-20 -70.26 -45.37 66.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.181 -0.918 . . . . 0.63 109.929 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -58.0 -40.48 80.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.97 111.059 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.404 ' HB2' HD23 ' B' ' 205' ' ' LEU . 57.9 mt -72.4 -37.54 68.65 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.165 -0.47 . . . . 0.20000000000000001 110.519 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 219' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 48.3 ttp180 -56.43 -41.33 76.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 1.29 110.221 175.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 93.5 t -70.57 -49.11 54.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.548 -0.751 . . . . 0.19 109.866 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.07 -48.6 79.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.849 -1.069 . . . . 0.25 110.793 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -66.23 -38.22 87.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.632 -0.713 . . . . 1.24 110.552 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.1 tttt -64.59 -36.73 85.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.835 -0.346 . . . . 0.34999999999999998 110.783 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 54.1 mt-10 -74.13 -30.57 62.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.611 -0.514 . . . . 2.27 109.611 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.46 -43.72 84.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.621 -0.718 . . . . 0.16 109.67 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 226' ' ' TRP . . . . . . . . . . . . . 57.2 t90 -64.64 -39.76 94.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.323 -0.853 . . . . 0.19 110.096 177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.9 mmm180 -63.58 -39.13 93.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 2.25 110.985 177.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.2 m -74.07 -4.57 36.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.556 -0.293 . . . . 1.1799999999999999 111.353 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 25.1 t -79.89 -11.78 59.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.93000000000000005 109.78 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.49 -0.767 . . . . 1.27 110.134 178.185 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.532 0.252 0 N-CA-C 112.618 0.599 . . . . 1.24 112.618 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.65 -28.03 12.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.321 -0.552 . . . . 0.34999999999999998 110.491 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.468 HG22 HD11 ' B' ' 209' ' ' LEU . 40.7 t -68.5 -23.26 27.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.506 0.67 . . . . 0.23999999999999999 109.912 177.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.61 12.28 6.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.725 -0.671 . . . . 0.23999999999999999 111.658 -178.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 48.4 p -106.9 145.67 31.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.246 0.546 . . . . 0.26000000000000001 110.108 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.13 -32.15 73.7 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.38 -0.827 . . . . 2.46 109.776 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.63 -36.47 82.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.736 -0.665 . . . . 0.26000000000000001 111.564 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -61.8 -50.9 70.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.016 0.436 . . . . 0.22 109.959 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -69.07 -28.58 66.66 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.17000000000000001 111.463 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.56 -49.39 71.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 1.23 110.281 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -72.68 -33.58 66.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.247 -0.433 . . . . 1.3700000000000001 111.137 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.96 -47.53 84.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.229 -0.656 . . . . 0.17999999999999999 109.229 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 55.7 tt0 -65.94 -35.54 80.89 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.954 -0.566 . . . . 0.70999999999999996 110.302 175.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -58.74 -41.96 96.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.033 -0.603 . . . . 0.16 112.017 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -67.44 -38.12 84.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.456 -0.572 . . . . 1.26 109.456 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.5 mp -65.91 -35.44 80.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.394 -0.821 . . . . 0.19 110.68 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 206' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.9 mt-10 -64.53 -48.89 73.42 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.94 0.4 . . . . 1.1299999999999999 110.48 177.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 48.4 mt-30 -65.44 -41.83 93.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.908 -0.587 . . . . 1.1299999999999999 111.622 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.64 -50.78 16.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.176 -0.465 . . . . 1.97 111.447 -177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.0 mp -78.16 -22.11 49.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.45000000000000001 112.071 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.57 16.12 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.899 0.749 . . . . 2.1899999999999999 110.464 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.4 118.97 3.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.237 -0.438 . . . . 1.1200000000000001 110.384 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -68.7 -37.78 79.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.771 -0.649 . . . . 1.4199999999999999 111.609 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.82 -49.66 71.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.401 -0.363 . . . . 2.0099999999999998 111.096 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.62 -31.09 70.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.198 0.523 . . . . 1.48 110.04 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.26 84.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 0.20000000000000001 110.029 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 59.9 t30 -69.2 -44.51 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.516 -0.765 . . . . 0.63 109.978 177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.18 -41.51 84.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.851 -0.613 . . . . 1.99 110.887 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.471 HD11 HG21 ' B' ' 192' ' ' VAL . 40.8 mt -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.105 -0.498 . . . . 0.20000000000000001 110.731 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -59.96 -43.67 94.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.023 0.44 . . . . 1.29 110.184 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.616 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 64.5 t -70.48 -46.7 69.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.694 -0.685 . . . . 0.19 109.546 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.19 -49.07 78.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.02 -0.991 . . . . 0.26000000000000001 110.728 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -67.72 -36.82 81.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.508 -0.769 . . . . 1.25 110.579 -178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.508 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.3 tttt -68.42 -33.86 74.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.638 0.256 . . . . 0.35999999999999999 110.96 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 51.1 mm-40 -75.4 -29.25 59.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.326 0.584 . . . . 2.2799999999999998 109.723 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' B' ' 225' ' ' ALA . . . -67.98 -40.31 83.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.384 -0.825 . . . . 0.16 109.2 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -65.52 -38.59 90.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.957 -1.02 . . . . 0.19 109.892 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 40.4 mmt180 -58.98 -41.13 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 2.25 110.383 173.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 17.6 m -73.85 -10.0 59.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 1.1599999999999999 111.49 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 15.9 t -74.59 -13.77 60.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.871 0.367 . . . . 0.93000000000000005 110.613 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.655 -0.688 . . . . 1.27 110.154 178.593 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 112.502 0.556 . . . . 1.24 112.502 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -80.1 -27.82 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.388 -0.525 . . . . 0.34000000000000002 110.536 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 218' ' ' LEU . 40.5 t -68.48 -23.39 28.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.502 0.668 . . . . 0.23000000000000001 110.003 177.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 11.96 6.32 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.596 -0.729 . . . . 0.23000000000000001 111.555 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 47.5 p -106.34 145.79 31.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.168 0.508 . . . . 0.25 110.199 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.2 -32.15 73.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.457 -0.792 . . . . 2.46 109.751 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.23 82.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.682 -0.69 . . . . 0.27000000000000002 111.625 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.91 -50.94 70.15 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.848 -0.427 . . . . 0.22 109.848 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -68.95 -28.79 66.96 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.39 -0.823 . . . . 0.16 111.557 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.48 -49.53 71.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.321 -0.4 . . . . 1.25 110.229 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.48 -33.63 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 1.3700000000000001 111.189 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.95 -47.54 84.71 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.228 -0.656 . . . . 0.17000000000000001 109.228 175.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.471 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 55.8 tt0 -65.91 -35.24 80.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.018 -0.537 . . . . 0.70999999999999996 110.324 175.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.02 -42.01 96.73 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.046 -0.597 . . . . 0.16 112.168 177.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -67.35 -38.1 84.29 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.574 -0.528 . . . . 1.26 109.574 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.5 mp -65.94 -35.48 80.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.493 -0.776 . . . . 0.20000000000000001 110.624 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 206' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.6 mt-10 -64.66 -48.68 73.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.794 0.33 . . . . 1.1399999999999999 110.423 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 48.7 mt-30 -65.72 -41.65 92.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 1.1299999999999999 111.564 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.59 -50.8 16.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.505 . . . . 1.98 111.431 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.0 mp -78.27 -22.19 48.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.45000000000000001 112.089 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.64 16.09 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.907 0.755 . . . . 2.1899999999999999 110.549 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.33 119.02 3.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 1.1100000000000001 110.393 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -68.65 -37.64 79.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.831 -0.622 . . . . 1.4099999999999999 111.557 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.0 -49.63 71.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.839 0.352 . . . . 2.0 111.035 -175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -68.83 -30.82 69.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.957 -0.565 . . . . 1.48 110.045 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.15 84.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.765 -0.652 . . . . 0.20999999999999999 110.092 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.457 ' O ' HG23 ' B' ' 220' ' ' VAL . 59.8 t30 -69.17 -44.59 71.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.499 -0.773 . . . . 0.63 109.985 177.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.15 -41.31 83.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 1.97 111.001 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.465 HD12 HD21 ' B' ' 209' ' ' LEU . 40.1 mt -73.21 -36.62 66.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.063 -0.517 . . . . 0.20000000000000001 110.682 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -60.0 -43.4 95.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.992 0.425 . . . . 1.29 110.218 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.6 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 62.0 t -70.6 -46.95 67.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 0.19 109.539 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.0 -48.87 78.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.924 -1.035 . . . . 0.25 110.855 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -67.82 -37.07 81.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.467 -0.788 . . . . 1.24 110.554 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.5 tttt -68.19 -34.24 75.93 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.068 -0.253 . . . . 0.34999999999999998 110.936 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 52.3 mm-40 -75.25 -29.27 60.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.467 0.651 . . . . 2.27 109.675 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 225' ' ' ALA . . . -67.94 -40.34 83.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.232 174.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.5 t90 -65.39 -38.58 90.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.019 -0.992 . . . . 0.19 109.933 177.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 40.5 mmt180 -58.99 -41.06 86.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 2.25 110.372 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.5 m -73.73 -10.12 59.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.077 -0.51 . . . . 1.1799999999999999 111.501 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 16.8 t -74.75 -13.65 60.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.975 0.417 . . . . 0.93000000000000005 110.512 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.687 -0.673 . . . . 1.27 110.358 178.977 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--O 1.228 -0.03 0 CA-C-O 120.774 0.321 . . . . 1.24 111.096 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 CA-C-N 116.359 -0.382 . . . . 0.34999999999999998 110.856 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.408 HG13 ' CE2' ' A' ' 197' ' ' PHE . 19.4 t -69.22 -20.16 24.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.457 0.646 . . . . 0.23999999999999999 110.018 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.411 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -89.0 11.63 17.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.898 -0.592 . . . . 0.23999999999999999 111.458 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 49.1 p -106.51 158.56 16.83 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.601 -0.44 . . . . 0.26000000000000001 110.764 -175.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.04 -39.14 89.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.863 -0.608 . . . . 2.46 109.615 175.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.97 -38.45 76.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.131 -0.94 . . . . 0.26000000000000001 112.292 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' PHE . . . . . 0.408 ' CE2' HG13 ' A' ' 192' ' ' VAL . 76.4 t80 -63.25 -51.31 66.71 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.749 -0.381 . . . . 0.22 110.348 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 198' ' ' TRP . . . . . 0.401 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 95.4 m95 -70.09 -29.13 66.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.803 -0.635 . . . . 0.17000000000000001 111.505 -178.043 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -64.14 -52.02 61.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.135 -0.484 . . . . 1.23 110.413 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -71.61 -32.39 67.96 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 1.3700000000000001 111.09 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.72 -46.75 86.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.171 -0.677 . . . . 0.17999999999999999 109.171 175.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.27 -37.31 86.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.70999999999999996 110.601 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.7 -39.52 95.35 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.938 -0.649 . . . . 0.16 112.142 176.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -66.14 -40.25 90.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.473 0.654 . . . . 1.26 109.294 177.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.9 mp -64.53 -34.28 77.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.07 -0.968 . . . . 0.19 110.487 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.66 -45.93 84.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.738 0.304 . . . . 1.1299999999999999 110.419 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.6 mt-30 -58.93 -47.54 84.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 1.1299999999999999 111.831 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.63 -45.41 17.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.236 -0.438 . . . . 1.97 112.136 -174.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.8 mp -82.16 -23.01 35.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.45000000000000001 112.004 -172.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 56.81 37.24 28.67 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 123.969 0.793 . . . . 2.1899999999999999 110.427 -176.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -156.47 110.3 2.71 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.566 -0.743 . . . . 1.1200000000000001 109.8 -177.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.78 -34.16 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 1.4199999999999999 111.222 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.27 -50.83 64.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.417 -0.356 . . . . 2.0099999999999998 111.25 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.75 -27.95 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.422 . . . . 1.48 110.02 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.49 -37.21 84.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.493 0.663 . . . . 0.20000000000000001 109.526 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 63.1 t30 -70.21 -46.63 64.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.274 -0.876 . . . . 0.63 110.121 178.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -58.27 -39.7 79.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.729 -0.669 . . . . 1.99 111.077 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.544 HD12 HD21 ' A' ' 209' ' ' LEU . 33.5 mt -73.67 -36.29 65.31 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.183 -0.462 . . . . 0.20000000000000001 110.653 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -57.66 -43.62 85.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.171 0.51 . . . . 1.29 110.007 177.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 58.8 t -71.38 -49.29 48.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.401 -0.818 . . . . 0.19 109.764 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.501 HD21 ' O ' ' B' ' 225' ' ' ALA . 56.6 tp -57.14 -48.2 79.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.867 -1.06 . . . . 0.26000000000000001 110.994 -177.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.39 -37.42 86.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.598 -0.728 . . . . 1.25 110.409 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.9 tttt -66.25 -33.64 76.21 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.836 -0.346 . . . . 0.35999999999999999 110.726 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.71 64.7 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.521 -0.548 . . . . 2.2799999999999998 109.521 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 225' ' ' ALA . . . . . 0.467 ' O ' HD21 ' B' ' 221' ' ' LEU . . . -68.29 -42.17 79.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.374 -0.83 . . . . 0.16 109.672 176.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.411 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -63.69 -39.03 93.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.276 -0.875 . . . . 0.19 110.131 177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 227' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.6 mmm180 -64.12 -34.4 77.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.312 -0.403 . . . . 2.25 110.351 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -77.37 -7.35 55.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.526 -0.306 . . . . 1.1599999999999999 111.032 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 32.4 t -75.21 -17.16 60.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.53 0.681 . . . . 0.93000000000000005 109.563 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.413 -0.803 . . . . 1.27 109.684 176.966 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.581 0.229 . . . . 1.24 111.146 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.64 -36.37 77.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.368 -0.378 . . . . 0.34000000000000002 110.816 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.414 HG22 HD11 ' A' ' 209' ' ' LEU . 19.2 t -68.98 -20.37 24.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.529 0.68 . . . . 0.23000000000000001 110.002 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.42 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -89.05 11.54 18.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.876 -0.602 . . . . 0.23000000000000001 111.52 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 50.1 p -106.52 158.65 16.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.93 0.395 . . . . 0.25 110.577 -175.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -65.97 -39.27 90.24 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.497 -0.557 . . . . 2.46 109.497 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.86 -38.65 76.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.157 -0.928 . . . . 0.27000000000000002 112.36 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 197' ' ' PHE . . . . . 0.402 ' CE2' HG13 ' B' ' 192' ' ' VAL . 75.7 t80 -63.33 -51.2 66.97 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.714 -0.394 . . . . 0.22 110.332 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -70.09 -29.07 65.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.926 -0.579 . . . . 0.16 111.502 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.21 -52.11 60.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.458 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -71.66 -32.28 67.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.138 -0.483 . . . . 1.3700000000000001 111.018 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.7 -46.69 86.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.255 -0.646 . . . . 0.17000000000000001 109.255 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.26 -37.19 86.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.856 -0.611 . . . . 0.70999999999999996 110.618 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 203' ' ' GLY . . . . . 0.451 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.0 -39.1 95.21 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.994 -0.622 . . . . 0.16 112.163 176.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -66.4 -40.26 89.52 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.535 0.683 . . . . 1.26 109.4 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.8 mp -64.68 -34.27 77.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.106 -0.952 . . . . 0.20000000000000001 110.516 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.49 -46.24 83.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.772 0.32 . . . . 1.1399999999999999 110.271 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 207' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 53.4 mt-30 -58.9 -47.37 85.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.554 . . . . 1.1299999999999999 111.8 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.77 -45.4 17.06 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.163 0.431 . . . . 1.98 112.163 -174.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.7 mp -82.14 -22.97 35.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.259 -0.428 . . . . 0.45000000000000001 112.045 -172.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.78 37.45 28.81 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.987 0.804 . . . . 2.1899999999999999 110.398 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -156.71 109.92 2.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.472 -0.786 . . . . 1.1100000000000001 109.845 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -67.53 -34.23 76.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.012 -0.54 . . . . 1.4099999999999999 111.285 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.22 -50.93 63.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.51 -0.314 . . . . 2.0 111.098 -176.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -70.81 -27.76 64.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.019 0.438 . . . . 1.48 110.049 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.56 -37.26 84.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.583 0.706 . . . . 0.20999999999999999 109.594 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.447 ' O ' HG23 ' B' ' 220' ' ' VAL . 62.6 t30 -70.08 -46.86 64.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.185 -0.916 . . . . 0.63 110.124 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -57.85 -40.15 79.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.714 -0.676 . . . . 1.97 111.116 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.527 HD12 HD21 ' B' ' 209' ' ' LEU . 32.9 mt -73.4 -36.3 66.0 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.179 -0.464 . . . . 0.20000000000000001 110.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -57.73 -43.49 85.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.152 0.501 . . . . 1.29 110.06 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.579 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 60.5 t -71.43 -49.33 47.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.457 -0.792 . . . . 0.19 109.798 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 221' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 225' ' ' ALA . 56.7 tp -56.98 -48.16 79.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.968 -1.014 . . . . 0.25 111.061 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.5 -37.56 87.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.581 -0.736 . . . . 1.24 110.235 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 223' ' ' LYS . . . . . 0.538 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.0 tttt -65.99 -33.84 76.72 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.86 -0.336 . . . . 0.34999999999999998 110.707 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.579 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.63 64.65 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.556 -0.535 . . . . 2.27 109.556 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 225' ' ' ALA . . . . . 0.501 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -68.38 -42.19 79.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.394 -0.821 . . . . 0.16 109.602 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.42 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.8 t90 -63.68 -38.93 92.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.285 -0.87 . . . . 0.19 110.249 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 227' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.5 mmm180 -64.24 -34.43 78.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 2.25 110.397 176.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.1 t -77.48 -6.86 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.444 -0.344 . . . . 1.1799999999999999 111.147 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 31.6 t -75.52 -16.9 60.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.452 -0.573 . . . . 0.93000000000000005 109.452 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.419 -0.801 . . . . 1.27 109.966 176.98 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 26.4 t . . . . . 0 C--O 1.23 0.062 0 N-CA-C 111.637 0.236 . . . . 1.24 111.637 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.6 -33.16 58.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.553 0.216 . . . . 0.34999999999999998 111.122 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.439 HG13 ' CE2' ' A' ' 197' ' ' PHE . 44.0 t -69.14 -22.55 26.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.405 0.622 . . . . 0.23999999999999999 110.183 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -86.16 12.36 9.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.837 -0.62 . . . . 0.23999999999999999 111.756 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 36.9 p -108.43 155.32 20.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.013 0.435 . . . . 0.26000000000000001 110.844 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -65.37 -32.97 74.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.75 -0.659 . . . . 2.46 109.262 174.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.01 -41.88 88.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.035 -0.984 . . . . 0.26000000000000001 111.982 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' PHE . . . . . 0.446 ' CE1' HD11 ' B' ' 209' ' ' LEU . 54.2 t80 -64.3 -50.35 68.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.726 -0.39 . . . . 0.22 110.557 -179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.1 -28.5 66.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.071 -0.513 . . . . 0.17000000000000001 110.97 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -63.74 -49.7 72.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.998 -0.547 . . . . 1.23 110.433 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -70.94 -34.09 71.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.207 -0.452 . . . . 1.3700000000000001 110.929 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 205' ' ' LEU . 2.9 tm? -60.21 -48.04 83.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.957 -0.565 . . . . 0.17999999999999999 109.739 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.442 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 47.1 tt0 -68.8 -34.7 75.96 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.677 -0.409 . . . . 0.70999999999999996 110.364 176.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.09 95.41 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.16 111.773 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -67.62 -38.39 83.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 4.9 mp -66.03 -37.35 85.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.832 -0.622 . . . . 0.19 110.608 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -64.09 -47.36 80.35 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.713 0.292 . . . . 1.1299999999999999 110.552 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -66.85 -43.23 84.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.177 -0.465 . . . . 1.1299999999999999 111.77 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 8.7 tpt85 -75.15 -48.44 23.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.915 0.388 . . . . 1.97 111.308 -175.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -77.24 -22.07 52.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.912 -0.585 . . . . 0.45000000000000001 112.172 -176.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 63.11 32.46 15.21 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 124.131 0.895 . . . . 2.1899999999999999 110.509 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.17 118.69 4.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 1.1200000000000001 110.426 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -67.96 -40.06 83.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 1.4199999999999999 112.085 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -62.2 -51.37 68.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.591 -0.277 . . . . 2.0099999999999998 111.16 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.73 -28.26 64.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.358 -0.383 . . . . 1.48 110.462 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.58 -40.86 84.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.423 0.63 . . . . 0.20000000000000001 109.975 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.423 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.2 t-20 -69.05 -45.53 70.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.122 -0.944 . . . . 0.63 109.78 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.55 -40.49 87.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.364 -0.835 . . . . 1.99 111.149 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 218' ' ' LEU . . . . . 0.472 HD12 HD21 ' A' ' 209' ' ' LEU . 45.6 mt -72.77 -36.87 67.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.406 -0.361 . . . . 0.20000000000000001 110.238 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 219' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 40.6 ttp180 -56.43 -42.13 77.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.213 0.53 . . . . 1.29 110.172 175.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.589 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 99.5 t -71.33 -49.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.665 -0.698 . . . . 0.19 109.925 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 50.2 tp -56.63 -49.7 74.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.922 -1.036 . . . . 0.26000000000000001 111.095 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -64.61 -36.93 85.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.224 -0.898 . . . . 1.25 110.491 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -68.57 -29.87 68.52 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.739 -0.384 . . . . 0.35999999999999999 111.018 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 48.6 mt-10 -73.23 -33.78 65.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.311 -0.626 . . . . 2.2799999999999998 109.311 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.82 -40.29 79.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.41 -0.813 . . . . 0.16 109.835 177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 58.1 t90 -65.13 -41.94 94.35 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.126 -0.943 . . . . 0.19 110.148 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -63.97 -37.98 89.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.043 -0.526 . . . . 2.25 111.089 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 43.4 m -73.71 -5.22 39.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.768 0.318 . . . . 1.1599999999999999 111.641 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 64.0 m -85.75 -9.46 57.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.181 0.515 . . . . 0.93000000000000005 110.412 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.685 -0.674 . . . . 1.27 109.748 176.901 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 25.9 t . . . . . 0 CA--C 1.528 0.105 0 CA-C-O 120.66 0.266 . . . . 1.24 111.632 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 191' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.6 p -68.53 -32.95 57.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.657 0.265 . . . . 0.34000000000000002 111.092 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.432 HG13 ' CE2' ' B' ' 197' ' ' PHE . 43.6 t -69.24 -22.64 26.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.264 0.554 . . . . 0.23000000000000001 110.256 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.403 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.29 12.14 10.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.867 -0.606 . . . . 0.23000000000000001 111.625 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 35.8 p -108.15 155.31 20.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.917 0.389 . . . . 0.25 110.753 -175.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.38 -32.99 74.92 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.238 -0.653 . . . . 2.46 109.238 174.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.98 88.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.141 -0.936 . . . . 0.27000000000000002 111.83 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 197' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 209' ' ' LEU . 54.4 t80 -64.18 -50.43 68.15 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.658 -0.417 . . . . 0.22 110.565 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.13 -28.36 66.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.1 -0.5 . . . . 0.16 110.972 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -63.76 -49.86 71.34 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 1.25 110.481 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.84 -34.02 71.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.284 -0.417 . . . . 1.3700000000000001 110.867 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 201' ' ' LEU . . . . . 0.412 ' O ' HD13 ' B' ' 205' ' ' LEU . 2.9 tm? -60.15 -48.01 83.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.17000000000000001 109.726 177.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.466 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 47.3 tt0 -68.81 -35.09 76.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.407 -0.36 . . . . 0.70999999999999996 110.399 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -57.95 -41.97 94.58 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.827 -0.701 . . . . 0.16 111.742 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.96 -38.04 82.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.722 -0.473 . . . . 1.26 109.722 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 4.9 mp -66.44 -37.17 84.58 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.862 -0.608 . . . . 0.20000000000000001 110.652 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -63.96 -47.81 78.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.781 0.324 . . . . 1.1399999999999999 110.532 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -66.43 -43.22 86.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 1.1299999999999999 111.878 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -75.18 -48.45 23.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.831 0.348 . . . . 1.98 111.295 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.9 mp -77.34 -21.88 52.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.98 -0.555 . . . . 0.45000000000000001 112.171 -176.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 62.85 32.48 15.8 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 124.135 0.897 . . . . 2.1899999999999999 110.593 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -155.15 118.57 4.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 1.1100000000000001 110.285 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.86 -40.07 83.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.953 -0.567 . . . . 1.4099999999999999 112.069 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -62.23 -51.13 69.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.648 0.261 . . . . 2.0 111.191 -174.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.01 -28.17 64.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.886 0.374 . . . . 1.48 110.422 -177.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.54 -41.01 84.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.506 0.669 . . . . 0.20999999999999999 109.958 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.422 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.4 t-20 -69.13 -45.55 69.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.095 -0.957 . . . . 0.63 109.757 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.39 -40.42 86.54 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.404 -0.816 . . . . 1.97 111.245 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 218' ' ' LEU . . . . . 0.478 HD12 HD21 ' B' ' 209' ' ' LEU . 45.5 mt -72.79 -36.87 67.68 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.336 -0.393 . . . . 0.20000000000000001 110.284 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 219' ' ' ARG . . . . . 0.466 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 40.8 ttp180 -56.46 -42.21 77.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.18 0.514 . . . . 1.29 110.125 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.578 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 97.2 t -71.28 -49.66 46.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.634 -0.712 . . . . 0.19 109.969 -178.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 50.0 tp -56.62 -49.43 75.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.908 -1.042 . . . . 0.25 111.115 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -64.8 -37.3 87.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.201 -0.909 . . . . 1.24 110.324 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -68.3 -30.06 68.96 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.758 -0.377 . . . . 0.34999999999999998 110.908 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 48.3 mt-10 -73.22 -33.24 65.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.415 -0.587 . . . . 2.27 109.415 178.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.17 77.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.399 -0.818 . . . . 0.16 109.701 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.403 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 58.4 t90 -65.32 -41.85 93.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.187 177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -64.13 -37.81 88.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.53 . . . . 2.25 111.146 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 43.8 m -73.99 -4.74 37.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.508 -0.314 . . . . 1.1799999999999999 111.693 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 66.3 m -85.88 -9.79 56.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.118 0.485 . . . . 0.93000000000000005 110.426 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.553 -0.737 . . . . 1.27 109.917 177.05 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.468 0.175 . . . . 1.24 110.65 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.0 p -70.59 -33.92 55.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-O 120.82 0.343 . . . . 0.34999999999999998 110.78 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 192' ' ' VAL . . . . . 0.455 HG13 ' CE2' ' A' ' 197' ' ' PHE . 39.0 t -71.48 -19.75 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.704 0.764 . . . . 0.23999999999999999 109.679 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' ALA . . . . . 0.468 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.14 11.59 11.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.468 -0.787 . . . . 0.23999999999999999 111.466 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.9 p -106.02 151.22 24.92 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.26000000000000001 110.193 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -65.76 -32.9 74.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.7 -0.682 . . . . 2.46 109.304 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.55 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.925 -1.034 . . . . 0.26000000000000001 111.782 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' PHE . . . . . 0.455 ' CE2' HG13 ' A' ' 192' ' ' VAL . 57.1 t80 -62.22 -50.23 72.59 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.737 0.303 . . . . 0.22 110.244 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -68.75 -28.86 67.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.785 -0.643 . . . . 0.17000000000000001 111.51 -177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.94 -47.82 73.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.68 0.276 . . . . 1.23 110.386 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -66.64 -37.44 84.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.956 0.407 . . . . 1.3700000000000001 110.598 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.89 -47.69 84.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.757 . . . . 0.17999999999999999 109.867 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' GLN . . . . . 0.548 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 53.1 tt0 -69.04 -31.88 70.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.341 -0.391 . . . . 0.70999999999999996 110.478 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.78 -41.34 99.61 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.16 111.509 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.0 -37.84 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.68 -0.489 . . . . 1.26 109.68 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.0 mp -66.78 -35.97 81.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.676 -0.693 . . . . 0.19 110.793 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.02 -46.95 82.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.77 0.319 . . . . 1.1299999999999999 110.677 176.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -66.62 -41.46 88.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.094 -0.503 . . . . 1.1299999999999999 111.768 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.0 tpt85 -74.69 -48.99 22.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.893 0.377 . . . . 1.97 111.387 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -80.73 -22.58 40.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.659 0.614 . . . . 0.45000000000000001 112.659 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 14.4 mptt 62.99 35.09 13.46 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.679 0.612 . . . . 2.1899999999999999 110.626 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -156.61 118.95 3.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.058 0.456 . . . . 1.1200000000000001 110.592 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -67.97 -40.12 83.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.511 -0.768 . . . . 1.4199999999999999 111.818 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 213' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 217' ' ' LYS . 6.5 m-20 -62.46 -51.34 67.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.377 . . . . 2.0099999999999998 111.307 -173.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -70.81 -31.06 67.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.919 0.39 . . . . 1.48 110.313 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.61 -39.44 91.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.20000000000000001 110.132 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -70.29 -47.36 61.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.63 110.1 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 217' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 213' ' ' ASP . 68.0 mttm -60.91 -37.01 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.775 -0.648 . . . . 1.99 111.094 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 44.4 mt -72.48 -39.97 67.28 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.306 -0.407 . . . . 0.20000000000000001 110.271 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 219' ' ' ARG . . . . . 0.548 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 37.2 ttp180 -55.16 -42.31 72.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.142 0.496 . . . . 1.29 110.288 176.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 220' ' ' VAL . . . . . 0.635 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 85.9 t -71.13 -49.56 47.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.558 -0.746 . . . . 0.19 109.851 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.89 -48.5 78.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.937 -1.029 . . . . 0.26000000000000001 111.025 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.14 -36.96 85.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 1.25 110.317 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -67.46 -31.73 72.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.35999999999999999 110.846 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 44.3 mt-10 -75.42 -31.48 60.39 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.466 -0.568 . . . . 2.2799999999999998 109.466 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.15 -41.63 77.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.428 -0.806 . . . . 0.16 109.662 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 226' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 56.0 t90 -64.38 -37.74 88.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.165 -0.925 . . . . 0.19 110.1 177.181 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.77 -35.0 79.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.227 -0.442 . . . . 2.25 110.756 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 19.7 t -74.95 -9.68 58.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.938 0.399 . . . . 1.1599999999999999 110.923 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 23.2 t -75.42 -12.51 60.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.166 0.508 . . . . 0.93000000000000005 110.229 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.651 -0.69 . . . . 1.27 110.327 178.773 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.639 0.256 . . . . 1.24 110.721 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.59 -34.18 56.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.34000000000000002 110.809 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 192' ' ' VAL . . . . . 0.458 HG13 ' CE2' ' B' ' 197' ' ' PHE . 39.1 t -71.38 -19.63 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.688 0.756 . . . . 0.23000000000000001 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 193' ' ' ALA . . . . . 0.466 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.15 11.57 11.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.431 -0.804 . . . . 0.23000000000000001 111.642 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.6 p -106.05 151.35 24.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.022 0.439 . . . . 0.25 110.165 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.99 -32.88 74.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.637 -0.71 . . . . 2.46 109.245 175.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.68 92.76 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.873 -1.058 . . . . 0.27000000000000002 111.691 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 197' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' B' ' 192' ' ' VAL . 56.0 t80 -62.25 -50.26 72.44 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.894 0.378 . . . . 0.22 110.093 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.7 -28.91 67.26 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.624 -0.716 . . . . 0.16 111.558 -177.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.88 -47.9 73.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.722 0.296 . . . . 1.25 110.38 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -66.39 -37.71 85.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.995 0.426 . . . . 1.3700000000000001 110.387 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.74 -47.8 84.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.655 -0.702 . . . . 0.17000000000000001 109.931 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.543 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 53.6 tt0 -68.95 -31.81 70.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.369 -0.378 . . . . 0.70999999999999996 110.5 178.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.82 -41.45 99.63 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.749 -0.739 . . . . 0.16 111.512 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.8 -38.0 85.64 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.691 -0.485 . . . . 1.26 109.691 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.0 mp -66.63 -36.03 81.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.20000000000000001 110.806 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -64.03 -46.76 83.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.82 0.343 . . . . 1.1399999999999999 110.6 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.8 -41.25 87.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 1.1299999999999999 111.926 -178.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -74.87 -49.11 21.59 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.833 0.349 . . . . 1.98 111.292 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 209' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.0 mp -80.67 -22.66 40.24 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.524 0.564 . . . . 0.45000000000000001 112.524 -175.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 14.3 mptt 62.95 34.98 13.66 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.658 0.599 . . . . 2.1899999999999999 110.717 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -156.56 118.86 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.076 0.465 . . . . 1.1100000000000001 110.536 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -67.97 -40.26 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.551 -0.749 . . . . 1.4099999999999999 111.866 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.12 -51.44 67.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 2.0 111.34 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -70.8 -31.04 67.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.923 0.392 . . . . 1.48 110.274 -178.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.69 -39.4 91.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.412 0.625 . . . . 0.20999999999999999 110.025 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 216' ' ' ASN . . . . . 0.464 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.3 t-20 -70.25 -47.45 61.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.208 -0.905 . . . . 0.63 110.099 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.9 -37.04 80.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.77 -0.65 . . . . 1.97 111.013 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.1 mt -72.43 -40.01 67.42 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.325 -0.398 . . . . 0.20000000000000001 110.203 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 219' ' ' ARG . . . . . 0.543 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 36.9 ttp180 -55.14 -42.18 72.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.088 0.47 . . . . 1.29 110.299 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 220' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 79.0 t -71.27 -49.59 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.19 109.816 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 60.7 tp -56.73 -48.73 77.11 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.961 -1.018 . . . . 0.25 111.039 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.01 -37.01 86.23 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.462 -0.79 . . . . 1.24 110.291 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.32 -31.96 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.012 -0.275 . . . . 0.34999999999999998 110.801 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 224' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 43.8 mt-10 -75.21 -31.65 60.95 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.525 -0.546 . . . . 2.27 109.525 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.87 -41.68 78.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.523 -0.762 . . . . 0.16 109.65 175.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 226' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 56.3 t90 -64.39 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.251 -0.886 . . . . 0.19 110.132 177.204 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.9 -34.87 78.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 2.25 110.658 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 24.2 t -74.63 -10.26 59.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.8 0.333 . . . . 1.1799999999999999 110.891 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.1 t -75.24 -12.56 60.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.181 0.515 . . . . 0.93000000000000005 110.371 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.636 -0.697 . . . . 1.27 110.467 178.667 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo . . . . . 0 N--CA 1.481 0.755 0 N-CA-C 110.851 -0.48 . . . . 1.9099999999999999 110.851 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 28.8 p -80.94 -21.83 40.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 2.1000000000000001 111.181 174.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.431 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 108.76 67.98 0.61 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.715 -0.755 . . . . 1.6699999999999999 112.572 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -167.52 -55.18 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.09 0.471 . . . . 1.96 110.182 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 18.2 m -60.72 -36.5 78.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.767 -0.651 . . . . 1.24 110.954 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.29 -33.92 47.65 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-O 120.779 0.323 . . . . 0.34999999999999998 110.377 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.476 HG22 HD11 ' B' ' 209' ' ' LEU . 22.3 t -69.89 -19.69 22.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.678 0.751 . . . . 0.23999999999999999 109.73 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.515 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.21 12.04 10.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.546 -0.752 . . . . 0.23999999999999999 111.522 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 34.1 p -108.98 146.28 34.12 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.485 0.66 . . . . 0.26000000000000001 110.562 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.95 -31.57 72.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 2.46 110.012 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.18 -40.5 94.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.4 -0.818 . . . . 0.26000000000000001 111.427 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.14 -49.98 73.69 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.338 -0.392 . . . . 0.22 109.943 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.82 -29.22 67.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.61 -0.723 . . . . 0.17000000000000001 111.845 -177.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.38 -48.3 70.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.799 0.333 . . . . 1.23 110.232 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.32 -33.84 73.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 1.3700000000000001 110.928 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.14 -47.13 86.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.921 -0.581 . . . . 0.17999999999999999 109.609 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.445 ' HB2' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.6 -32.19 72.76 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.438 -0.347 . . . . 0.70999999999999996 110.2 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.02 -41.7 96.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.959 -0.639 . . . . 0.16 111.735 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.14 -41.13 90.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.441 0.638 . . . . 1.26 109.534 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.425 HD23 ' HB2' ' A' ' 218' ' ' LEU . 3.0 mp -63.59 -37.93 89.21 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.094 -0.957 . . . . 0.19 110.434 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -66.76 -42.88 85.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.66 -0.245 . . . . 1.1299999999999999 110.664 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 49.7 mt-30 -57.51 -46.07 84.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.878 0.37 . . . . 1.1299999999999999 111.567 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.96 -41.32 20.97 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.484 0.55 . . . . 1.97 112.484 -175.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.47 HD11 HG22 ' B' ' 192' ' ' VAL . 8.3 mp -86.26 -22.46 26.83 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.049 0.389 . . . . 0.45000000000000001 112.049 -172.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.53 39.61 17.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.622 -0.717 . . . . 2.1899999999999999 110.991 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -157.99 117.33 3.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.955 0.407 . . . . 1.1200000000000001 110.221 -177.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.58 -44.29 82.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.569 -0.741 . . . . 1.4199999999999999 111.778 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -69.72 -40.67 76.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.532 -0.304 . . . . 2.0099999999999998 111.142 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 4.6 tp10 -68.31 -40.21 81.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.329 0.585 . . . . 1.48 109.866 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.54 -32.71 74.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.403 -0.817 . . . . 0.20000000000000001 109.887 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 220' ' ' VAL . 65.4 t30 -69.76 -44.22 70.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.996 -1.002 . . . . 0.63 110.006 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -56.58 -42.65 79.03 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.389 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.425 ' HB2' HD23 ' A' ' 205' ' ' LEU . 53.7 mt -72.84 -35.18 67.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.656 -0.702 . . . . 0.20000000000000001 110.502 -177.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 219' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 202' ' ' GLN . 50.2 ttp180 -57.89 -42.99 85.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.03 0.443 . . . . 1.29 110.271 176.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 60.5 t -71.23 -49.08 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.639 -0.71 . . . . 0.19 109.806 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.409 HD21 ' O ' ' B' ' 225' ' ' ALA . 65.2 tp -57.36 -49.52 75.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.701 -1.136 . . . . 0.26000000000000001 110.964 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -66.3 -36.92 84.19 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.778 -0.647 . . . . 1.25 110.706 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 88.0 tttt -66.71 -34.54 78.08 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.67 -0.412 . . . . 0.35999999999999999 110.824 179.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 10.9 mm-40 -75.79 -30.49 59.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.135 0.493 . . . . 2.2799999999999998 109.822 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.37 -42.94 82.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.592 -0.731 . . . . 0.16 109.482 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 36.6 t90 -63.28 -36.2 82.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.121 -0.945 . . . . 0.19 110.096 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.572 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.7 82.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.263 -0.426 . . . . 2.25 110.626 175.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 14.5 t -76.61 -9.29 58.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.201 -0.454 . . . . 1.1599999999999999 110.785 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 35.1 t -75.19 -12.03 60.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.193 0.52 . . . . 0.93000000000000005 110.348 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.695 -0.669 . . . . 1.27 110.355 178.07 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo . . . . . 0 N--CA 1.479 0.665 0 N-CA-C 110.856 -0.478 . . . . 1.8899999999999999 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 32.7 p -80.16 -22.57 41.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 2.1000000000000001 111.027 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.428 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 109.24 68.35 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.676 -0.773 . . . . 1.6799999999999999 112.503 178.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -167.96 -55.24 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.116 0.484 . . . . 1.97 110.058 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 17.1 m -60.59 -36.71 79.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.841 -0.618 . . . . 1.24 110.834 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.13 -33.99 48.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 CA-C-O 120.721 0.296 . . . . 0.34000000000000002 110.269 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.47 HG22 HD11 ' A' ' 209' ' ' LEU . 22.2 t -69.82 -19.68 22.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.573 0.701 . . . . 0.23000000000000001 109.736 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.518 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.16 11.84 11.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.623 -0.717 . . . . 0.23000000000000001 111.486 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 34.4 p -108.87 146.17 34.15 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.572 0.701 . . . . 0.25 110.457 -175.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.79 -31.72 72.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.768 -1.105 . . . . 2.46 109.939 176.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.1 -40.29 93.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.518 -0.764 . . . . 0.27000000000000002 111.487 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.34 -50.1 72.97 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.332 -0.395 . . . . 0.22 109.991 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.71 -29.29 67.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.594 -0.73 . . . . 0.16 111.861 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.3 -48.48 70.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.8 0.333 . . . . 1.25 110.155 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.16 -33.95 74.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.378 -0.374 . . . . 1.3700000000000001 110.784 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -58.99 -47.16 86.18 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.003 -0.544 . . . . 0.17000000000000001 109.589 175.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.433 ' HB2' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.67 -32.07 72.48 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 116.459 -0.337 . . . . 0.70999999999999996 110.328 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.628 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.25 -41.55 96.83 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.968 -0.634 . . . . 0.16 111.594 175.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -66.21 -41.12 90.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.413 0.625 . . . . 1.26 109.509 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.415 HD23 ' HB2' ' B' ' 218' ' ' LEU . 3.0 mp -63.49 -38.06 89.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.108 -0.951 . . . . 0.20000000000000001 110.54 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -66.64 -43.16 85.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.672 -0.24 . . . . 1.1399999999999999 110.552 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.628 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 49.7 mt-30 -57.21 -46.13 83.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.429 -0.35 . . . . 1.1299999999999999 111.588 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -82.09 -41.17 20.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.425 0.528 . . . . 1.98 112.425 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.476 HD11 HG22 ' A' ' 192' ' ' VAL . 8.4 mp -86.26 -22.68 26.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.982 0.364 . . . . 0.45000000000000001 111.982 -172.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.45 40.07 17.63 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.909 0.756 . . . . 2.1899999999999999 110.758 -177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -158.2 117.37 3.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.888 0.375 . . . . 1.1100000000000001 110.319 -177.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -66.6 -44.28 82.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.604 -0.726 . . . . 1.4099999999999999 111.801 -177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.75 -41.05 75.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.445 -0.343 . . . . 2.0 111.045 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 214' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 4.5 tp10 -67.98 -40.28 83.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.437 0.637 . . . . 1.48 110.002 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.8 74.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 0.20999999999999999 109.915 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.414 ' O ' HG23 ' B' ' 220' ' ' VAL . 65.2 t30 -69.56 -44.57 70.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.107 -0.952 . . . . 0.63 110.028 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -56.23 -42.93 78.08 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 116.137 -0.483 . . . . 1.97 110.377 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.415 ' HB2' HD23 ' B' ' 205' ' ' LEU . 54.2 mt -72.77 -35.04 67.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.689 -0.687 . . . . 0.20000000000000001 110.578 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 219' ' ' ARG . . . . . 0.433 ' HD3' ' HB2' ' B' ' 202' ' ' GLN . 50.1 ttp180 -57.83 -43.2 85.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.101 0.477 . . . . 1.29 110.18 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 59.6 t -71.16 -49.07 51.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.708 -0.678 . . . . 0.19 109.891 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.3 tp -57.23 -49.75 75.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.756 -1.111 . . . . 0.25 111.035 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -66.24 -36.79 83.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.76 -0.654 . . . . 1.24 110.731 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.557 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 87.9 tttt -66.84 -34.5 77.95 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.663 -0.415 . . . . 0.34999999999999998 110.795 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 12.0 mm-40 -75.75 -30.2 59.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.095 0.474 . . . . 2.27 109.796 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 225' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -67.64 -42.87 81.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.539 -0.755 . . . . 0.16 109.458 174.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.518 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 36.9 t90 -63.33 -36.23 82.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.207 -0.906 . . . . 0.19 110.151 176.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.99 82.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 2.25 110.386 175.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 19.5 t -76.36 -9.15 58.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.261 -0.427 . . . . 1.1799999999999999 110.871 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 33.5 t -75.35 -11.81 60.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.057 0.456 . . . . 0.93000000000000005 110.313 178.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.606 -0.711 . . . . 1.27 110.406 177.712 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.478 0.611 0 N-CA-C 110.17 -0.742 . . . . 1.9099999999999999 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 18.0 t -118.9 60.13 0.82 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.276 0.56 . . . . 2.1000000000000001 110.475 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' GLY . . . . . . . . . . . . . . . 112.85 -109.04 2.27 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.62 -0.8 . . . . 1.6699999999999999 113.105 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -56.73 -44.28 81.48 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.458 0.54 . . . . 1.96 112.458 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.7 t -42.45 -42.18 3.18 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.28 0.844 . . . . 1.24 113.28 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 14.8 p -86.74 -31.41 6.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.284 -0.567 . . . . 0.34999999999999998 111.009 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.461 HG22 HD11 ' B' ' 209' ' ' LEU . 28.1 t -68.28 -21.38 26.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.366 0.603 . . . . 0.23999999999999999 110.231 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.46 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.28 11.36 12.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.99 -0.55 . . . . 0.23999999999999999 111.354 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 46.1 p -106.32 145.66 31.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.279 0.561 . . . . 0.26000000000000001 109.998 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -65.45 -32.4 74.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.189 -0.914 . . . . 2.46 109.692 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.76 -37.87 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.366 -0.833 . . . . 0.26000000000000001 111.745 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -62.68 -50.8 69.72 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.967 -0.383 . . . . 0.22 109.967 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.18 -29.38 67.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.635 -0.711 . . . . 0.17000000000000001 111.553 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.88 -48.75 70.49 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.028 0.442 . . . . 1.23 110.316 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -72.45 -32.54 66.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 1.3700000000000001 110.938 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.46 -47.1 85.13 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.037 -0.727 . . . . 0.17999999999999999 109.037 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.46 ' HB2' ' HD2' ' A' ' 219' ' ' ARG . 49.8 tt0 -66.05 -33.84 76.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.145 -0.479 . . . . 0.70999999999999996 110.299 176.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.493 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -61.41 -39.82 97.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.829 -0.701 . . . . 0.16 112.068 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.45 -38.64 87.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.542 0.687 . . . . 1.26 109.258 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -65.55 -33.6 76.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.686 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.01 -43.63 87.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.869 0.366 . . . . 1.1299999999999999 110.476 175.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 51.4 mt-30 -59.99 -46.99 87.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.989 -0.551 . . . . 1.1299999999999999 111.532 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 208' ' ' ARG . 9.7 mmt180 -79.29 -47.02 16.6 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.431 0.53 . . . . 1.97 112.431 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.49 HD21 HD12 ' A' ' 218' ' ' LEU . 8.7 mp -81.87 -21.95 37.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.346 -0.388 . . . . 0.45000000000000001 111.858 -172.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.56 35.31 20.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 2.1899999999999999 110.658 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -157.93 118.79 3.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 1.1200000000000001 110.128 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -68.15 -37.4 81.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.625 -0.716 . . . . 1.4199999999999999 111.496 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.11 -50.12 62.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.236 -0.438 . . . . 2.0099999999999998 111.294 -175.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.71 -33.1 74.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.171 0.51 . . . . 1.48 109.925 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.4 87.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.531 0.682 . . . . 0.20000000000000001 110.115 178.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' ' 220' ' ' VAL . 63.3 t30 -69.68 -43.02 73.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.248 -0.887 . . . . 0.63 109.759 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.43 -37.8 84.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.566 -0.743 . . . . 1.99 111.215 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.49 HD12 HD21 ' A' ' 209' ' ' LEU . 32.5 mt -72.71 -36.34 67.8 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.829 -0.348 . . . . 0.20000000000000001 110.44 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 219' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 202' ' ' GLN . 64.4 ttt180 -57.25 -41.97 80.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.099 0.476 . . . . 1.29 110.358 175.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.4 t -70.45 -48.71 58.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.666 -0.697 . . . . 0.19 109.968 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.28 -48.71 80.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.995 -1.002 . . . . 0.26000000000000001 110.845 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.69 83.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.684 -0.689 . . . . 1.25 110.538 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.552 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.8 tttt -67.66 -33.89 75.85 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.705 -0.398 . . . . 0.35999999999999999 110.798 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 28.3 mm-40 -74.58 -30.64 61.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 2.2799999999999998 109.69 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.27 -41.35 85.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 0.16 109.411 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.46 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.0 t90 -65.11 -39.36 92.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.066 -0.97 . . . . 0.19 109.963 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.2 mmm180 -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.086 -0.506 . . . . 2.25 111.09 176.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.08 -4.62 36.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.148 0.499 . . . . 1.1599999999999999 110.972 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 24.3 t -80.22 -14.46 58.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.493 -0.558 . . . . 0.93000000000000005 109.493 176.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.717 -0.659 . . . . 1.27 110.048 177.631 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.477 0.55 0 N-CA-C 110.284 -0.699 . . . . 1.8899999999999999 110.284 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 19.8 t -118.72 59.77 0.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 2.1000000000000001 110.434 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 113.17 -109.09 2.25 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.707 -0.759 . . . . 1.6799999999999999 113.054 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -56.49 -44.41 80.63 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.529 0.566 . . . . 1.97 112.529 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 31.9 t -42.55 -41.61 3.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.239 0.829 . . . . 1.24 113.239 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 14.9 p -87.18 -31.45 5.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.238 -0.585 . . . . 0.34000000000000002 111.125 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.443 HG22 HD11 ' A' ' 209' ' ' LEU . 27.7 t -68.11 -21.37 26.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.498 0.666 . . . . 0.23000000000000001 110.381 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.52 11.67 12.11 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.907 -0.588 . . . . 0.23000000000000001 111.373 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 45.1 p -106.34 145.88 31.12 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.245 0.545 . . . . 0.25 110.019 -175.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.71 -32.3 73.78 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.136 -0.938 . . . . 2.46 109.678 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.93 84.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.349 -0.841 . . . . 0.27000000000000002 111.578 176.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.73 -50.75 69.87 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.902 -0.407 . . . . 0.22 109.902 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.12 -29.4 67.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.634 -0.712 . . . . 0.16 111.662 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -66.14 -48.52 70.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.04 0.448 . . . . 1.25 110.336 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -72.51 -32.57 66.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.226 -0.443 . . . . 1.3700000000000001 110.95 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' LEU . . . . . 0.401 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.9 tm? -58.51 -47.15 85.09 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.108 -0.701 . . . . 0.17000000000000001 109.108 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.474 ' HB2' ' HD2' ' B' ' 219' ' ' ARG . 50.0 tt0 -65.93 -34.03 77.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.70999999999999996 110.322 176.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.484 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -61.06 -40.37 98.42 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.827 -0.701 . . . . 0.16 112.051 176.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -66.0 -38.61 88.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.646 0.736 . . . . 1.26 109.2 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 2.9 mp -65.58 -33.57 76.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.936 -1.029 . . . . 0.20000000000000001 110.719 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.93 -44.23 85.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.837 0.351 . . . . 1.1399999999999999 110.411 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 50.2 mt-30 -59.48 -47.0 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.984 -0.553 . . . . 1.1299999999999999 111.636 179.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.38 -47.11 16.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.289 0.478 . . . . 1.98 112.289 -175.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.487 HD21 HD12 ' B' ' 218' ' ' LEU . 8.7 mp -81.65 -21.94 37.85 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.845 0.313 . . . . 0.45000000000000001 111.845 -172.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.28 35.6 20.78 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 124.098 0.874 . . . . 2.1899999999999999 110.574 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -158.06 118.71 3.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 1.1100000000000001 110.214 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -68.08 -37.54 81.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.665 -0.698 . . . . 1.4099999999999999 111.525 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.94 -49.93 63.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.199 -0.455 . . . . 2.0 111.326 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -68.03 -33.13 74.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 1.48 109.965 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.39 87.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 0.20999999999999999 110.095 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.482 ' O ' HG23 ' B' ' 220' ' ' VAL . 63.5 t30 -69.63 -43.14 73.3 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.372 -0.831 . . . . 0.63 109.792 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.38 -37.89 85.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.462 -0.79 . . . . 1.97 111.103 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.487 HD12 HD21 ' B' ' 209' ' ' LEU . 32.4 mt -72.59 -36.53 68.17 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.772 -0.371 . . . . 0.20000000000000001 110.348 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 219' ' ' ARG . . . . . 0.474 ' HD2' ' HB2' ' B' ' 202' ' ' GLN . 64.0 ttt180 -56.98 -42.08 79.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.064 0.459 . . . . 1.29 110.244 175.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 216' ' ' ASN . 80.1 t -70.48 -48.61 58.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.19 109.946 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.7 tp -59.46 -48.53 81.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.956 -1.02 . . . . 0.25 110.817 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.87 84.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.643 -0.708 . . . . 1.24 110.646 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.561 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.8 tttt -67.45 -34.12 76.55 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.799 -0.361 . . . . 0.34999999999999998 110.79 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 28.4 mm-40 -74.61 -30.55 61.72 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.223 0.535 . . . . 2.27 109.728 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.19 -41.26 86.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.483 -0.781 . . . . 0.16 109.452 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.6 t90 -65.14 -39.33 92.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.02 -0.991 . . . . 0.19 109.984 177.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.561 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.3 mmm180 -64.6 -40.16 95.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 2.25 111.075 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.2 t -74.06 -4.94 38.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.046 0.45 . . . . 1.1799999999999999 110.905 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.4 t -79.76 -14.85 58.42 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.65 -0.5 . . . . 0.93000000000000005 109.65 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.625 -0.702 . . . . 1.27 110.094 177.655 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.475 0.422 0 N-CA-C 110.466 -0.628 . . . . 1.9099999999999999 110.466 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.9 t -132.5 60.98 1.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.909 -0.774 . . . . 2.1000000000000001 108.909 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.416 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 90.09 -154.71 23.9 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.292 -0.867 . . . . 1.6699999999999999 111.876 -174.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 30.82 -82.14 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.594 1.558 . . . . 1.96 114.986 175.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 8.7 m -46.51 -45.94 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.327 0.651 . . . . 1.24 112.497 -175.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.585 HG11 ' HA ' ' B' ' 209' ' ' LEU . 7.5 p -75.29 -30.35 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.34999999999999998 110.812 -179.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 40.4 t -69.6 -20.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.565 0.698 . . . . 0.23999999999999999 109.701 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.431 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.33 10.95 13.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.574 -0.739 . . . . 0.23999999999999999 111.404 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 40.1 p -106.56 144.47 33.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.211 0.529 . . . . 0.26000000000000001 110.005 -175.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.93 -31.23 72.03 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.278 -0.874 . . . . 2.46 109.429 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.65 89.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.106 -0.952 . . . . 0.26000000000000001 111.247 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -61.71 -48.44 80.74 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.938 0.399 . . . . 0.22 109.971 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.78 -28.67 66.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.572 -0.74 . . . . 0.17000000000000001 111.664 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -66.37 -48.99 68.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.834 0.349 . . . . 1.23 110.358 174.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.36 -37.91 86.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.05 0.452 . . . . 1.3700000000000001 110.682 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.18 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.585 -0.734 . . . . 0.17999999999999999 109.735 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.447 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 60.9 tt0 -64.2 -36.75 85.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.025 -0.534 . . . . 0.70999999999999996 110.387 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.522 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.0 -41.79 98.07 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.034 -0.603 . . . . 0.16 112.069 177.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -66.56 -39.07 88.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.172 0.51 . . . . 1.26 109.637 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.5 mp -64.98 -34.15 77.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.565 -0.743 . . . . 0.19 110.539 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 47.3 mt-10 -65.97 -43.98 86.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.674 0.274 . . . . 1.1299999999999999 110.488 176.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 46.3 mt-30 -62.85 -48.81 77.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.433 . . . . 1.1299999999999999 111.691 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.8 tpt85 -77.87 -43.61 29.66 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.989 -0.551 . . . . 1.97 111.531 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.609 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 3.1 mp -84.25 -23.29 30.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.243 -0.435 . . . . 0.45000000000000001 112.16 -176.168 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.37 36.27 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.84 0.713 . . . . 2.1899999999999999 111.133 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -156.88 117.09 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.994 -0.548 . . . . 1.1200000000000001 110.266 -177.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -67.79 -37.19 81.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.684 -0.689 . . . . 1.4199999999999999 111.355 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -62.58 -50.18 72.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.318 -0.401 . . . . 2.0099999999999998 110.917 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.49 -37.62 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.972 -0.558 . . . . 1.48 110.005 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.11 -41.65 90.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.82 -0.627 . . . . 0.20000000000000001 110.618 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 220' ' ' VAL . 0.2 OUTLIER -70.87 -41.94 70.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.597 -0.728 . . . . 0.63 110.253 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -59.95 -43.07 95.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.013 -0.54 . . . . 1.99 110.684 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.426 HD12 HD21 ' A' ' 209' ' ' LEU . 63.1 mt -72.91 -34.86 66.88 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.744 -0.662 . . . . 0.20000000000000001 110.196 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -57.42 -44.32 84.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.134 0.492 . . . . 1.29 110.036 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 216' ' ' ASN . 73.4 t -71.68 -49.23 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.674 -0.694 . . . . 0.19 110.28 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.69 -48.68 80.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.028 -0.987 . . . . 0.26000000000000001 110.783 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -65.23 -38.85 91.69 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.649 -0.705 . . . . 1.25 110.585 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.3 tttt -65.75 -33.84 76.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.841 -0.343 . . . . 0.35999999999999999 110.866 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -76.97 -29.33 55.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.944 0.402 . . . . 2.2799999999999998 110.248 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.74 87.25 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.767 -0.652 . . . . 0.16 109.358 173.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.431 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.7 t90 -63.61 -37.1 86.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.061 -0.972 . . . . 0.19 109.965 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 37.1 mmt180 -62.34 -37.85 87.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.157 -0.474 . . . . 2.25 110.686 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 18.4 t -75.23 -10.05 59.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.308 -0.406 . . . . 1.1599999999999999 110.962 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.2 t -76.61 -7.35 55.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.037 0.446 . . . . 0.93000000000000005 109.89 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.708 -0.663 . . . . 1.27 109.894 175.867 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.477 0.508 0 N-CA-C 110.572 -0.588 . . . . 1.8899999999999999 110.572 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 22.7 t -132.61 61.03 1.68 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.943 -0.762 . . . . 2.1000000000000001 108.943 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.439 ' HA2' ' HG ' ' A' ' 209' ' ' LEU . . . 89.7 -154.66 24.17 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.504 -0.771 . . . . 1.6799999999999999 111.859 -174.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 31.05 -82.19 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.462 1.505 . . . . 1.97 114.888 175.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 6.9 m -46.62 -46.09 19.48 Favored 'General case' 0 N--CA 1.462 0.139 0 C-N-CA 123.337 0.655 . . . . 1.24 112.409 -175.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 191' ' ' VAL . . . . . 0.515 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.5 p -74.95 -30.68 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.794 0.331 . . . . 0.34000000000000002 110.868 -178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.48 -20.79 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.681 0.753 . . . . 0.23000000000000001 109.74 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.434 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.04 10.9 12.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.42 -0.809 . . . . 0.23000000000000001 111.551 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 41.5 p -106.75 144.3 33.6 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.216 0.531 . . . . 0.25 109.968 -175.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -65.86 -31.33 72.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.253 -0.885 . . . . 2.46 109.373 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.72 89.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.121 -0.945 . . . . 0.27000000000000002 111.356 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -61.63 -48.48 80.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.941 -0.392 . . . . 0.22 109.941 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.67 -28.59 67.01 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.666 -0.697 . . . . 0.16 111.707 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.44 -48.99 68.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.72 0.295 . . . . 1.25 110.385 174.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -66.31 -37.97 86.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.966 0.412 . . . . 1.3700000000000001 110.737 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.2 -47.0 86.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 0.17000000000000001 109.646 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 61.1 tt0 -63.85 -36.95 85.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.70999999999999996 110.459 177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.513 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.18 -41.74 98.32 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.104 -0.569 . . . . 0.16 111.996 177.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -66.48 -39.11 88.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.62 -0.511 . . . . 1.26 109.62 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.4 mp -64.96 -34.1 77.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.623 -0.717 . . . . 0.20000000000000001 110.434 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 206' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 45.2 mt-10 -66.22 -43.49 86.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.734 0.302 . . . . 1.1399999999999999 110.499 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 46.7 mt-30 -63.22 -48.92 76.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.019 0.437 . . . . 1.1299999999999999 111.808 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 3.9 tpt85 -77.81 -43.47 30.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.959 -0.564 . . . . 1.98 111.456 -173.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 2.9 mp -84.17 -23.51 30.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.227 -0.442 . . . . 0.45000000000000001 112.187 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.54 35.97 26.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.582 -0.735 . . . . 2.1899999999999999 111.131 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -156.5 117.41 3.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.005 -0.543 . . . . 1.1100000000000001 110.238 -177.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -67.85 -37.42 81.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.766 -0.652 . . . . 1.4099999999999999 111.367 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.45 -50.31 71.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 2.0 110.817 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.44 -37.37 87.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.084 -0.507 . . . . 1.48 109.957 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.32 -41.59 89.43 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.887 -0.597 . . . . 0.20999999999999999 110.644 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' B' ' 220' ' ' VAL . 0.2 OUTLIER -70.77 -42.28 70.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.665 -0.698 . . . . 0.63 110.184 -179.402 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -59.71 -43.07 94.27 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.97 110.67 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.411 HD12 HD21 ' B' ' 209' ' ' LEU . 63.3 mt -72.94 -34.75 66.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.85 -0.614 . . . . 0.20000000000000001 110.241 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -57.66 -44.28 85.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.06 0.457 . . . . 1.29 110.06 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 216' ' ' ASN . 66.7 t -71.54 -49.45 46.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.749 -0.659 . . . . 0.19 110.277 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.9 tp -58.3 -48.7 79.67 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.002 -0.999 . . . . 0.25 110.981 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -65.13 -38.93 92.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.668 -0.696 . . . . 1.24 110.577 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.2 tttt -65.56 -34.08 77.42 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.929 -0.309 . . . . 0.34999999999999998 110.926 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -76.92 -29.33 55.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.09 0.471 . . . . 2.27 110.096 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.47 -42.65 87.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.29 -0.633 . . . . 0.16 109.29 173.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.434 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 52.6 t90 -63.62 -37.08 85.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.995 -1.002 . . . . 0.19 110.017 176.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 37.0 mmt180 -62.37 -37.63 86.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 2.25 110.859 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.9 t -75.58 -9.95 59.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 1.1799999999999999 110.788 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 19.4 t -76.46 -7.84 55.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.172 0.51 . . . . 0.93000000000000005 110.054 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.652 -0.689 . . . . 1.27 109.849 175.893 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.44 ' HB2' ' HB ' ' A' ' 191' ' ' VAL . 9.5 Cg_endo . . . . . 0 N--CA 1.481 0.747 0 N-CA-C 110.703 -0.537 . . . . 1.9099999999999999 110.703 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 41.1 m 56.46 150.91 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 122.002 0.906 . . . . 2.1000000000000001 113.43 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . -82.64 53.93 4.87 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.877 -0.678 . . . . 1.6699999999999999 112.099 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -173.71 -57.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 1.96 109.759 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m -50.86 -50.37 57.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.713 -0.676 . . . . 1.24 112.102 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.448 HG21 ' HG3' ' B' ' 208' ' ' ARG . 11.9 p -70.06 -32.85 52.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.773 -0.371 . . . . 0.34999999999999998 110.939 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 22.1 t -66.97 -19.85 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.69 0.757 . . . . 0.23999999999999999 109.749 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.458 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -90.04 12.2 18.41 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.613 -0.721 . . . . 0.23999999999999999 111.597 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 42.8 p -107.86 152.18 24.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.227 0.536 . . . . 0.26000000000000001 110.362 -176.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.51 -32.69 74.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.385 -0.825 . . . . 2.46 109.708 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.61 90.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.23 -0.896 . . . . 0.26000000000000001 111.863 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -62.35 -50.94 69.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.22 110.236 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -69.18 -28.27 66.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.705 -0.679 . . . . 0.17000000000000001 111.448 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.66 -51.98 65.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 1.23 110.509 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.65 -32.5 65.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.275 -0.42 . . . . 1.3700000000000001 111.371 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.86 -47.78 83.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.166 -0.679 . . . . 0.17999999999999999 109.166 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.2 tt0 -67.0 -33.18 75.0 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.925 -0.58 . . . . 0.70999999999999996 110.195 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.77 -40.12 97.7 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.928 -0.653 . . . . 0.16 111.906 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -67.16 -38.73 85.98 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.528 -0.545 . . . . 1.26 109.528 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.7 mp -66.19 -38.19 87.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.529 -0.76 . . . . 0.19 110.561 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 206' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.7 mt-10 -63.36 -48.54 77.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.362 . . . . 1.1299999999999999 110.863 176.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 95.9 mt-30 -66.24 -40.94 90.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.357 -0.383 . . . . 1.1299999999999999 112.011 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.467 ' HG3' HG21 ' B' ' 191' ' ' VAL . 5.0 tpt180 -77.75 -48.47 16.57 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.814 0.301 . . . . 1.97 111.814 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.1 mp -82.31 -23.34 35.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 0.45000000000000001 111.784 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 207' ' ' GLN . 33.9 mmtp 58.76 39.82 23.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.274 -0.875 . . . . 2.1899999999999999 110.487 -174.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -153.1 109.4 3.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.572 -0.74 . . . . 1.1200000000000001 109.812 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -67.61 -36.43 80.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.279 -0.419 . . . . 1.4199999999999999 111.497 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -64.05 -50.4 68.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.871 0.367 . . . . 2.0099999999999998 110.712 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 8.6 tp10 -70.67 -29.86 66.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.095 -0.502 . . . . 1.48 110.29 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.35 85.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.547 0.689 . . . . 0.20000000000000001 109.752 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 220' ' ' VAL . 58.9 t30 -70.1 -46.25 65.25 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.066 -0.97 . . . . 0.63 110.318 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -59.07 -40.72 86.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 1.99 110.899 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.63 -36.89 68.14 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.003 -0.544 . . . . 0.20000000000000001 110.38 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -58.94 -42.55 90.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.926 0.393 . . . . 1.29 110.388 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.9 t -71.13 -44.63 74.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.924 -0.58 . . . . 0.19 109.707 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.0 tp -57.24 -50.86 71.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.891 -1.049 . . . . 0.26000000000000001 110.89 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.75 -37.14 81.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.212 -0.904 . . . . 1.25 110.591 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.7 tttt -66.09 -36.38 83.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.35999999999999999 110.68 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.192 0.52 . . . . 2.2799999999999998 110.042 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.17 -40.57 86.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.493 -0.776 . . . . 0.16 109.346 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.458 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 47.5 t90 -67.35 -39.81 85.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.063 -0.971 . . . . 0.19 110.366 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.609 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.6 mmm180 -61.32 -39.06 89.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.966 0.412 . . . . 2.25 110.467 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.06 -6.21 46.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 1.1599999999999999 111.131 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 65.8 m -84.52 -9.59 58.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.989 0.423 . . . . 0.93000000000000005 110.667 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.289 -0.862 . . . . 1.27 110.184 176.074 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 186' ' ' PRO . . . . . 0.448 ' HB2' ' HB ' ' B' ' 191' ' ' VAL . 9.3 Cg_endo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.514 -0.61 . . . . 1.8899999999999999 110.514 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 41.4 m 56.49 150.69 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.219 -0.9 . . . . 2.1000000000000001 113.345 -177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.47 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . -82.27 54.1 4.84 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.897 -0.668 . . . . 1.6799999999999999 112.166 176.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -173.83 -56.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.693 -0.484 . . . . 1.97 109.693 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m -50.85 -50.4 56.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.83 -0.623 . . . . 1.24 111.959 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 191' ' ' VAL . . . . . 0.467 HG21 ' HG3' ' A' ' 208' ' ' ARG . 12.1 p -70.18 -32.95 52.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 C-N-CA 120.961 -0.296 . . . . 0.34000000000000002 110.883 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 22.4 t -66.95 -19.88 26.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.619 0.723 . . . . 0.23000000000000001 109.747 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.464 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -90.1 12.37 17.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.613 -0.721 . . . . 0.23000000000000001 111.432 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.99 152.12 24.9 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.376 0.607 . . . . 0.25 110.355 -176.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.4 -32.65 74.16 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.295 -0.866 . . . . 2.46 109.826 176.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.75 90.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.331 -0.85 . . . . 0.27000000000000002 111.856 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -62.16 -51.08 69.28 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.22 110.196 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -69.1 -28.13 66.21 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.621 -0.718 . . . . 0.16 111.536 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.64 -51.96 65.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.851 0.358 . . . . 1.25 110.487 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.68 -32.52 65.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 1.3700000000000001 111.386 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.13 -47.58 84.76 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.194 -0.669 . . . . 0.17000000000000001 109.194 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.0 tt0 -66.99 -33.31 75.3 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.70999999999999996 110.252 176.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.75 -40.13 97.69 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 121.076 -0.583 . . . . 0.16 112.007 176.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -67.01 -38.73 86.47 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.566 -0.531 . . . . 1.26 109.566 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.6 mp -66.08 -38.38 88.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.433 -0.803 . . . . 0.20000000000000001 110.528 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 206' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.8 mt-10 -63.24 -48.81 76.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.841 0.353 . . . . 1.1399999999999999 110.801 176.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 95.8 mt-30 -66.09 -40.93 91.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.196 -0.456 . . . . 1.1299999999999999 111.971 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 208' ' ' ARG . . . . . 0.448 ' HG3' HG21 ' A' ' 191' ' ' VAL . 5.0 tpt180 -77.8 -48.53 16.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.753 0.311 . . . . 1.98 111.731 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.1 mp -82.38 -23.12 35.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.815 0.302 . . . . 0.45000000000000001 111.815 -175.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 210' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' B' ' 207' ' ' GLN . 33.9 mmtp 58.47 39.8 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.393 -0.822 . . . . 2.1899999999999999 110.484 -174.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.05 109.72 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.507 -0.769 . . . . 1.1100000000000001 109.736 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -67.55 -36.28 80.66 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.275 -0.421 . . . . 1.4099999999999999 111.49 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.33 -50.19 68.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.86 0.362 . . . . 2.0 110.804 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 214' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 8.3 tp10 -70.78 -29.88 66.2 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.126 -0.488 . . . . 1.48 110.113 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.23 85.63 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.516 0.674 . . . . 0.20999999999999999 109.641 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.415 ' O ' HG23 ' B' ' 220' ' ' VAL . 58.1 t30 -70.22 -46.63 64.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.14 -0.936 . . . . 0.63 110.27 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -58.65 -40.79 84.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 1.97 110.912 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.71 -36.61 67.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.002 -0.544 . . . . 0.20000000000000001 110.364 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -59.04 -42.63 90.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.898 0.38 . . . . 1.29 110.367 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 216' ' ' ASN . 84.6 t -71.23 -44.6 73.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.42 0.628 . . . . 0.19 109.678 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.12 -50.73 71.89 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.945 -1.025 . . . . 0.25 110.915 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.99 -37.34 81.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 1.24 110.609 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.608 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.7 tttt -65.87 -36.38 83.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.505 -0.316 . . . . 0.34999999999999998 110.716 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.21 -31.64 64.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.133 0.492 . . . . 2.27 109.921 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.62 86.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.16 109.341 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.464 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 47.1 t90 -67.49 -39.57 85.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.029 -0.987 . . . . 0.19 110.283 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.2 mmm180 -61.29 -39.34 90.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 2.25 110.423 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.31 -5.56 42.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 1.1799999999999999 111.167 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 59.6 m -84.84 -9.81 57.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.045 0.45 . . . . 0.93000000000000005 110.64 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.579 -0.724 . . . . 1.27 110.189 175.979 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo . . . . . 0 N--CA 1.475 0.39 0 N-CA-C 110.613 -0.572 . . . . 1.9099999999999999 110.613 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 16.7 p -89.0 67.98 8.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.259 -0.428 . . . . 2.1000000000000001 112.135 -173.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.676 ' O ' HG12 ' A' ' 191' ' ' VAL . . . 80.77 -92.32 1.43 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.858 -0.687 . . . . 1.6699999999999999 113.139 174.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.67 -35.52 79.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.481 . . . . 1.96 111.061 -174.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 42.4 t -54.74 -37.05 65.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 1.24 111.895 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.676 HG12 ' O ' ' A' ' 188' ' ' GLY . 9.5 p -79.56 -25.8 12.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 C-N-CA 120.231 -0.587 . . . . 0.34999999999999998 110.034 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.433 HG22 HD11 ' B' ' 209' ' ' LEU . 51.2 t -69.05 -25.0 28.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.411 0.625 . . . . 0.23999999999999999 109.815 176.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -82.64 12.05 5.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.726 -0.67 . . . . 0.23999999999999999 111.842 -177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.03 153.01 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.918 0.389 . . . . 0.26000000000000001 110.487 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.97 -34.77 78.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.866 -0.606 . . . . 2.46 109.747 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.26 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.453 -0.794 . . . . 0.26000000000000001 111.829 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' PHE . . . . . 0.479 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 59.3 t80 -61.9 -51.13 69.41 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.824 0.345 . . . . 0.22 110.099 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 198' ' ' TRP . . . . . 0.429 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 97.2 m95 -69.02 -28.38 66.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.496 -0.775 . . . . 0.17000000000000001 111.54 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.17 -49.77 70.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.279 -0.418 . . . . 1.23 110.408 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.01 -33.7 70.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 1.3700000000000001 110.904 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.405 ' O ' HD13 ' A' ' 205' ' ' LEU . 1.7 tm? -59.49 -47.63 84.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.378 -0.601 . . . . 0.17999999999999999 109.378 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.5 tt0 -66.47 -33.47 75.76 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.089 -0.505 . . . . 0.70999999999999996 110.272 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.8 -41.28 99.08 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 121.049 -0.596 . . . . 0.16 111.929 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -66.95 -38.4 86.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 1.26 109.784 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.8 mp -65.22 -37.76 88.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.582 -0.735 . . . . 0.19 110.475 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 206' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 49.7 mt-10 -65.9 -45.41 82.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.567 -0.288 . . . . 1.1299999999999999 110.828 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.0 mt-30 -61.97 -48.29 81.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.931 0.396 . . . . 1.1299999999999999 111.459 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -72.75 -48.31 39.57 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.941 -0.572 . . . . 1.97 111.383 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.455 HD11 HG22 ' B' ' 192' ' ' VAL . 6.6 mp -83.13 -23.12 33.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.079 -0.509 . . . . 0.45000000000000001 111.352 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.56 39.97 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.222 -0.899 . . . . 2.1899999999999999 109.928 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.85 113.75 3.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.624 -0.716 . . . . 1.1200000000000001 110.434 -176.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -67.87 -33.85 75.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.853 -0.612 . . . . 1.4199999999999999 111.244 -177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.67 -51.11 61.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.449 . . . . 2.0099999999999998 111.026 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -68.82 -35.09 76.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 1.48 109.988 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.82 -39.34 87.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.738 -0.664 . . . . 0.20000000000000001 110.486 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' A' ' 220' ' ' VAL . 58.1 t30 -66.98 -48.31 68.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.57 -0.741 . . . . 0.63 110.311 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.99 -39.22 77.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.88 -0.6 . . . . 1.99 111.027 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 42.7 mt -72.66 -39.43 67.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.138 -0.483 . . . . 0.20000000000000001 110.9 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.26 -41.02 87.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.059 0.457 . . . . 1.29 110.179 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.464 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 87.3 t -70.24 -44.69 77.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.689 -0.687 . . . . 0.19 109.66 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.0 -49.89 76.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.98 -1.009 . . . . 0.26000000000000001 110.624 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -68.1 -38.56 82.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.329 -0.85 . . . . 1.25 110.852 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.8 tttt -67.11 -36.16 81.34 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.823 -0.351 . . . . 0.35999999999999999 110.821 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 47.3 mm-40 -75.38 -28.9 59.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.04 0.447 . . . . 2.2799999999999998 110.024 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.2 -40.04 82.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.65 -0.705 . . . . 0.16 109.301 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 51.5 t90 -64.7 -40.21 94.98 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.917 -1.038 . . . . 0.19 109.851 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.8 mmm180 -62.97 -39.99 96.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.997 -0.547 . . . . 2.25 110.661 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 25.9 t -73.48 -6.1 44.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 1.1599999999999999 111.116 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.0 t -79.28 -13.56 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.154 0.502 . . . . 0.93000000000000005 109.756 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.576 -0.726 . . . . 1.27 110.01 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.475 0.425 0 N-CA-C 110.71 -0.535 . . . . 1.8899999999999999 110.71 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 14.7 p -88.85 68.42 8.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.024 0.44 . . . . 2.1000000000000001 112.034 -173.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.681 ' O ' HG12 ' B' ' 191' ' ' VAL . . . 80.56 -92.18 1.41 Allowed Glycine 0 C--O 1.226 -0.389 0 C-N-CA 120.986 -0.626 . . . . 1.6799999999999999 113.237 174.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.66 -35.7 80.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.064 0.459 . . . . 1.97 111.158 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 43.9 t -54.52 -37.17 65.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.879 -0.6 . . . . 1.24 111.931 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 191' ' ' VAL . . . . . 0.681 HG12 ' O ' ' B' ' 188' ' ' GLY . 9.4 p -79.58 -25.71 12.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 120.262 -0.575 . . . . 0.34000000000000002 109.96 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.455 HG22 HD11 ' A' ' 209' ' ' LEU . 51.5 t -69.09 -25.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.423 0.63 . . . . 0.23000000000000001 109.8 176.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -82.38 11.82 5.12 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.763 -0.653 . . . . 0.23000000000000001 111.949 -177.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.01 153.07 23.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.967 0.413 . . . . 0.25 110.49 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.0 -34.59 78.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.756 -0.656 . . . . 2.46 109.823 176.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.79 84.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.343 -0.844 . . . . 0.27000000000000002 111.828 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 197' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -61.81 -51.14 69.49 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.22 110.134 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 198' ' ' TRP . . . . . 0.437 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 97.2 m95 -69.17 -28.31 66.29 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.511 -0.768 . . . . 0.16 111.453 -178.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.11 -49.8 70.79 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.232 -0.44 . . . . 1.25 110.473 174.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.12 -33.75 70.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 1.3700000000000001 110.864 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' LEU . . . . . 0.41 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.8 tm? -59.23 -47.88 83.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.326 -0.62 . . . . 0.17000000000000001 109.326 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.423 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.4 tt0 -66.25 -33.63 76.18 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.969 -0.56 . . . . 0.70999999999999996 110.349 176.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.67 -41.07 98.79 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.057 -0.592 . . . . 0.16 111.873 176.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -67.32 -38.37 84.82 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.668 -0.493 . . . . 1.26 109.668 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.9 mp -65.13 -37.69 88.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.755 . . . . 0.20000000000000001 110.55 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 206' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 49.3 mt-10 -65.77 -45.82 81.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.589 -0.278 . . . . 1.1399999999999999 110.873 177.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 52.9 mt-30 -61.74 -48.27 81.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 1.1299999999999999 111.375 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 208' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' B' ' 208' ' ' ARG . 4.4 tpt180 -72.66 -48.18 41.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.81 -0.632 . . . . 1.98 111.482 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.6 mp -83.43 -23.02 32.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.05 -0.523 . . . . 0.45000000000000001 111.496 -176.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' B' ' 210' ' ' LYS . 45.4 tptt 55.67 39.62 30.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.254 -0.885 . . . . 2.1899999999999999 109.928 -175.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.79 113.52 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.594 -0.73 . . . . 1.1100000000000001 110.32 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -67.84 -33.71 75.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.792 -0.64 . . . . 1.4099999999999999 111.22 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.8 -51.09 61.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.233 -0.44 . . . . 2.0 110.91 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.95 -35.09 76.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.858 -0.61 . . . . 1.48 109.957 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.31 87.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.759 -0.655 . . . . 0.20999999999999999 110.45 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.446 ' O ' HG23 ' B' ' 220' ' ' VAL . 57.4 t30 -66.93 -48.46 68.55 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.56 -0.745 . . . . 0.63 110.382 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.97 -39.04 77.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.917 -0.583 . . . . 1.97 111.011 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.413 HD11 HG21 ' A' ' 192' ' ' VAL . 42.6 mt -72.82 -39.46 66.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.207 -0.451 . . . . 0.20000000000000001 110.916 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.17 -41.15 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 1.29 110.236 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 90.1 t -70.24 -44.66 77.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.684 -0.689 . . . . 0.19 109.647 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 61.0 tp -59.06 -49.61 77.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.869 -1.059 . . . . 0.25 110.683 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -68.33 -38.35 81.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.428 -0.805 . . . . 1.24 110.869 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.9 tttt -67.2 -36.23 81.3 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.837 -0.345 . . . . 0.34999999999999998 110.89 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 49.7 mm-40 -75.34 -28.74 59.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 2.27 110.056 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.94 81.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.639 -0.71 . . . . 0.16 109.313 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.3 t90 -64.8 -40.05 94.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.846 -1.07 . . . . 0.19 109.854 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.7 mmm180 -63.12 -40.08 96.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.867 -0.606 . . . . 2.25 110.693 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.6 t -73.38 -5.84 42.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.858 0.361 . . . . 1.1799999999999999 111.108 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 20.9 t -79.35 -13.71 59.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.157 0.503 . . . . 0.93000000000000005 109.847 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.245 0.832 0 CA-C-O 118.58 -0.724 . . . . 1.27 110.142 177.513 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 N--CA 1.478 0.562 0 N-CA-C 110.274 -0.702 . . . . 1.9099999999999999 110.274 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 33.2 t -158.19 66.06 0.46 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.039 0.447 . . . . 2.1000000000000001 110.802 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 54.86 37.23 61.59 Favored Glycine 0 C--O 1.225 -0.451 0 N-CA-C 115.027 0.771 . . . . 1.6699999999999999 115.027 175.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -174.89 -48.84 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.427 0.632 . . . . 1.96 109.908 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 2.5 p -59.85 -29.3 68.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.155 -0.93 . . . . 1.24 110.818 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 14.4 p -76.36 -30.36 19.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 116.236 -0.438 . . . . 0.34999999999999998 110.185 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.442 HG22 HD11 ' B' ' 209' ' ' LEU . 60.7 t -69.7 -23.68 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.545 0.688 . . . . 0.23999999999999999 109.614 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.24 12.43 5.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.477 -0.783 . . . . 0.23999999999999999 111.505 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.82 150.23 27.27 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.076 0.465 . . . . 0.26000000000000001 110.494 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.41 -34.14 77.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.417 -0.811 . . . . 2.46 109.844 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.0 -35.33 78.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.165 -0.925 . . . . 0.26000000000000001 111.809 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 58.9 t80 -63.87 -51.04 66.4 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.865 0.364 . . . . 0.22 110.123 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 198' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 93.9 m95 -68.11 -29.89 68.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 0.17000000000000001 111.255 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.9 -43.92 78.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.432 -0.349 . . . . 1.23 110.338 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -71.7 -35.85 70.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.212 0.53 . . . . 1.3700000000000001 109.75 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.65 -47.73 83.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.426 -0.806 . . . . 0.17999999999999999 109.348 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.507 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.62 -28.68 67.95 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.196 -0.457 . . . . 0.70999999999999996 110.204 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.27 -41.77 98.46 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.854 -0.689 . . . . 0.16 111.599 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -66.81 -38.24 86.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 1.26 109.87 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.1 mp -66.5 -40.03 89.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.754 -0.657 . . . . 0.19 110.698 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.13 -43.61 91.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.568 0.223 . . . . 1.1299999999999999 110.939 177.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.429 ' O ' ' HE2' ' A' ' 210' ' ' LYS . 49.4 mt-30 -60.8 -48.94 79.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.823 0.344 . . . . 1.1299999999999999 111.707 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.24 -43.49 51.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.153 -0.476 . . . . 1.97 111.55 -173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.459 HD11 HG22 ' B' ' 192' ' ' VAL . 7.9 mp -88.28 -23.71 23.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.218 -0.446 . . . . 0.45000000000000001 112.202 -174.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.429 ' HE2' ' O ' ' A' ' 207' ' ' GLN . 75.5 mmtt 55.09 38.61 30.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.868 -0.605 . . . . 2.1899999999999999 110.679 -175.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -150.03 110.68 4.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 1.1200000000000001 109.351 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -65.29 -38.98 91.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.133 -0.485 . . . . 1.4199999999999999 111.46 -175.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.37 -50.42 69.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.264 -0.425 . . . . 2.0099999999999998 111.02 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 5.0 tp10 -69.23 -35.1 75.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.002 0.43 . . . . 1.48 110.461 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.47 89.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.359 0.6 . . . . 0.20000000000000001 110.203 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 2.7 t-20 -70.19 -45.38 66.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.164 -0.925 . . . . 0.63 109.904 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -58.0 -40.44 80.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.645 -0.707 . . . . 1.99 111.134 177.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.401 ' HB2' HD23 ' A' ' 205' ' ' LEU . 56.7 mt -72.47 -37.51 68.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.16 -0.473 . . . . 0.20000000000000001 110.455 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' ARG . . . . . 0.507 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 48.4 ttp180 -56.36 -41.44 76.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.103 0.478 . . . . 1.29 110.155 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.612 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 89.2 t -70.57 -49.1 54.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.509 -0.768 . . . . 0.19 109.901 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.76 -48.74 78.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.867 -1.061 . . . . 0.26000000000000001 110.829 -177.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -66.27 -38.32 87.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.61 -0.723 . . . . 1.25 110.524 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.2 tttt -64.4 -36.9 85.67 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.35999999999999999 110.81 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 51.9 mt-10 -73.96 -30.59 62.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 2.2799999999999998 109.735 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.5 -43.51 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.658 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -64.69 -39.96 94.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.19 110.08 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.8 mmm180 -63.21 -39.23 94.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 2.25 111.088 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 22.0 m -73.98 -5.01 38.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.499 -0.319 . . . . 1.1599999999999999 111.446 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 27.4 t -79.66 -11.53 59.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.281 0.562 . . . . 0.93000000000000005 109.749 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.435 -0.793 . . . . 1.27 110.205 178.231 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo . . . . . 0 N--CA 1.479 0.662 0 N-CA-C 110.184 -0.737 . . . . 1.8899999999999999 110.184 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 34.2 t -157.73 65.76 0.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.065 0.459 . . . . 2.1000000000000001 110.674 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 55.37 37.13 64.82 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 114.939 0.736 . . . . 1.6799999999999999 114.939 175.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -174.99 -48.7 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 117.447 0.624 . . . . 1.97 109.872 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 2.7 p -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.32 -0.855 . . . . 1.24 110.746 177.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 191' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 14.5 p -76.12 -30.16 20.15 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.372 -0.376 . . . . 0.34000000000000002 110.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.459 HG22 HD11 ' A' ' 209' ' ' LEU . 60.5 t -69.82 -23.45 25.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.541 0.686 . . . . 0.23000000000000001 109.585 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.51 12.25 5.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.543 -0.753 . . . . 0.23000000000000001 111.516 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 42.1 p -107.58 150.18 27.16 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.191 0.519 . . . . 0.25 110.446 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.41 -34.21 77.76 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.358 -0.837 . . . . 2.46 109.777 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.29 78.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.267 -0.878 . . . . 0.27000000000000002 111.798 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 197' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -63.79 -50.86 67.33 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 120.914 0.388 . . . . 0.22 110.207 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 198' ' ' TRP . . . . . 0.471 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 94.0 m95 -68.39 -29.86 68.65 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.756 -0.657 . . . . 0.16 111.238 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -67.81 -43.6 79.26 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.836 0.35 . . . . 1.25 110.557 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.0 -35.76 69.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.326 0.584 . . . . 1.3700000000000001 109.84 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.7 -47.71 83.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.17000000000000001 109.31 175.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.61 -28.81 68.06 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 116.157 -0.474 . . . . 0.70999999999999996 110.24 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.21 -41.63 98.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.793 -0.718 . . . . 0.16 111.623 174.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -66.9 -38.07 85.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.004 0.43 . . . . 1.26 109.856 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.2 mp -66.77 -40.01 88.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.724 -0.671 . . . . 0.20000000000000001 110.623 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.96 -43.73 91.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.805 -0.18 . . . . 1.1399999999999999 110.896 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.431 ' O ' ' HE2' ' B' ' 210' ' ' LYS . 49.2 mt-30 -61.25 -48.08 83.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 1.1299999999999999 111.882 177.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.62 -43.64 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.21 -0.45 . . . . 1.98 111.476 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.442 HD11 HG22 ' A' ' 192' ' ' VAL . 8.1 mp -88.2 -23.88 23.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.065 -0.516 . . . . 0.45000000000000001 112.085 -174.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' B' ' 207' ' ' GLN . 75.4 mmtt 55.4 38.31 30.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.753 -0.658 . . . . 2.1899999999999999 110.689 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -149.64 110.76 4.38 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.701 -0.682 . . . . 1.1100000000000001 109.476 -176.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -64.98 -39.13 93.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 1.4099999999999999 111.611 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -63.33 -50.5 69.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.388 -0.369 . . . . 2.0 111.089 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 214' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 4.9 tp10 -69.3 -35.1 75.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 1.48 110.362 -176.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.04 -39.56 90.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.20999999999999999 110.209 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' B' ' 220' ' ' VAL . 2.7 t-20 -70.26 -45.37 66.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.181 -0.918 . . . . 0.63 109.929 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -58.0 -40.48 80.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.97 111.059 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.404 ' HB2' HD23 ' B' ' 205' ' ' LEU . 57.9 mt -72.4 -37.54 68.65 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.165 -0.47 . . . . 0.20000000000000001 110.519 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 219' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 48.3 ttp180 -56.43 -41.33 76.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 1.29 110.221 175.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 93.5 t -70.57 -49.11 54.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.548 -0.751 . . . . 0.19 109.866 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.07 -48.6 79.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.849 -1.069 . . . . 0.25 110.793 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -66.23 -38.22 87.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.632 -0.713 . . . . 1.24 110.552 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.1 tttt -64.59 -36.73 85.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.835 -0.346 . . . . 0.34999999999999998 110.783 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 54.1 mt-10 -74.13 -30.57 62.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.611 -0.514 . . . . 2.27 109.611 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.46 -43.72 84.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.621 -0.718 . . . . 0.16 109.67 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 226' ' ' TRP . . . . . . . . . . . . . 57.2 t90 -64.64 -39.76 94.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.323 -0.853 . . . . 0.19 110.096 177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.9 mmm180 -63.58 -39.13 93.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 2.25 110.985 177.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.2 m -74.07 -4.57 36.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.556 -0.293 . . . . 1.1799999999999999 111.353 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 25.1 t -79.89 -11.78 59.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.93000000000000005 109.78 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.49 -0.767 . . . . 1.27 110.134 178.185 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 N--CA 1.477 0.554 0 N-CA-C 110.021 -0.8 . . . . 1.9099999999999999 110.021 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.8 t -133.76 69.1 1.47 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.173 0.511 . . . . 2.1000000000000001 110.599 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.423 ' O ' HG12 ' A' ' 191' ' ' VAL . . . 117.25 -116.87 3.63 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.624 -0.798 . . . . 1.6699999999999999 113.524 176.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.97 -40.77 90.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.053 0.76 . . . . 1.96 113.053 -169.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 23.2 t -50.51 -41.85 54.14 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.618 0.599 . . . . 1.24 112.618 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 188' ' ' GLY . 10.5 p -79.65 -28.03 12.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.321 -0.552 . . . . 0.34999999999999998 110.491 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.468 HG22 HD11 ' B' ' 209' ' ' LEU . 40.7 t -68.5 -23.26 27.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.506 0.67 . . . . 0.23999999999999999 109.912 177.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.61 12.28 6.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.725 -0.671 . . . . 0.23999999999999999 111.658 -178.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 48.4 p -106.9 145.67 31.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.246 0.546 . . . . 0.26000000000000001 110.108 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.13 -32.15 73.7 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.38 -0.827 . . . . 2.46 109.776 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.63 -36.47 82.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.736 -0.665 . . . . 0.26000000000000001 111.564 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -61.8 -50.9 70.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.016 0.436 . . . . 0.22 109.959 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -69.07 -28.58 66.66 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.17000000000000001 111.463 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.56 -49.39 71.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 1.23 110.281 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -72.68 -33.58 66.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.247 -0.433 . . . . 1.3700000000000001 111.137 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.96 -47.53 84.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.229 -0.656 . . . . 0.17999999999999999 109.229 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 55.7 tt0 -65.94 -35.54 80.89 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.954 -0.566 . . . . 0.70999999999999996 110.302 175.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -58.74 -41.96 96.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.033 -0.603 . . . . 0.16 112.017 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -67.44 -38.12 84.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.456 -0.572 . . . . 1.26 109.456 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.5 mp -65.91 -35.44 80.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.394 -0.821 . . . . 0.19 110.68 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 206' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.9 mt-10 -64.53 -48.89 73.42 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.94 0.4 . . . . 1.1299999999999999 110.48 177.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 48.4 mt-30 -65.44 -41.83 93.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.908 -0.587 . . . . 1.1299999999999999 111.622 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.64 -50.78 16.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.176 -0.465 . . . . 1.97 111.447 -177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.0 mp -78.16 -22.11 49.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.45000000000000001 112.071 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.57 16.12 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.899 0.749 . . . . 2.1899999999999999 110.464 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.4 118.97 3.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.237 -0.438 . . . . 1.1200000000000001 110.384 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -68.7 -37.78 79.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.771 -0.649 . . . . 1.4199999999999999 111.609 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.82 -49.66 71.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.401 -0.363 . . . . 2.0099999999999998 111.096 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.62 -31.09 70.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.198 0.523 . . . . 1.48 110.04 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.26 84.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 0.20000000000000001 110.029 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 59.9 t30 -69.2 -44.51 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.516 -0.765 . . . . 0.63 109.978 177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.18 -41.51 84.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.851 -0.613 . . . . 1.99 110.887 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.471 HD11 HG21 ' B' ' 192' ' ' VAL . 40.8 mt -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.105 -0.498 . . . . 0.20000000000000001 110.731 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -59.96 -43.67 94.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.023 0.44 . . . . 1.29 110.184 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.616 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 64.5 t -70.48 -46.7 69.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.694 -0.685 . . . . 0.19 109.546 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.19 -49.07 78.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.02 -0.991 . . . . 0.26000000000000001 110.728 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -67.72 -36.82 81.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.508 -0.769 . . . . 1.25 110.579 -178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.508 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.3 tttt -68.42 -33.86 74.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.638 0.256 . . . . 0.35999999999999999 110.96 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 51.1 mm-40 -75.4 -29.25 59.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.326 0.584 . . . . 2.2799999999999998 109.723 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' B' ' 225' ' ' ALA . . . -67.98 -40.31 83.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.384 -0.825 . . . . 0.16 109.2 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -65.52 -38.59 90.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.957 -1.02 . . . . 0.19 109.892 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 40.4 mmt180 -58.98 -41.13 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 2.25 110.383 173.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 17.6 m -73.85 -10.0 59.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 1.1599999999999999 111.49 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 15.9 t -74.59 -13.77 60.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.871 0.367 . . . . 0.93000000000000005 110.613 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.655 -0.688 . . . . 1.27 110.154 178.593 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.477 0.504 0 N-CA-C 109.974 -0.818 . . . . 1.8899999999999999 109.974 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 24.0 t -133.9 69.24 1.47 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.154 0.502 . . . . 2.1000000000000001 110.689 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.418 ' O ' HG12 ' B' ' 191' ' ' VAL . . . 117.54 -117.05 3.66 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.636 -0.792 . . . . 1.6799999999999999 113.603 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -59.97 -40.68 89.91 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.127 0.788 . . . . 1.97 113.127 -169.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 22.9 t -50.48 -41.76 53.62 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.502 0.556 . . . . 1.24 112.502 -175.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 191' ' ' VAL . . . . . 0.418 HG12 ' O ' ' B' ' 188' ' ' GLY . 10.5 p -80.1 -27.82 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.388 -0.525 . . . . 0.34000000000000002 110.536 -178.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 218' ' ' LEU . 40.5 t -68.48 -23.39 28.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.502 0.668 . . . . 0.23000000000000001 110.003 177.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 11.96 6.32 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.596 -0.729 . . . . 0.23000000000000001 111.555 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 47.5 p -106.34 145.79 31.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.168 0.508 . . . . 0.25 110.199 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.2 -32.15 73.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.457 -0.792 . . . . 2.46 109.751 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.23 82.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.682 -0.69 . . . . 0.27000000000000002 111.625 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.91 -50.94 70.15 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.848 -0.427 . . . . 0.22 109.848 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -68.95 -28.79 66.96 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.39 -0.823 . . . . 0.16 111.557 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.48 -49.53 71.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.321 -0.4 . . . . 1.25 110.229 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.48 -33.63 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 1.3700000000000001 111.189 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.95 -47.54 84.71 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.228 -0.656 . . . . 0.17000000000000001 109.228 175.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.471 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 55.8 tt0 -65.91 -35.24 80.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.018 -0.537 . . . . 0.70999999999999996 110.324 175.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.02 -42.01 96.73 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.046 -0.597 . . . . 0.16 112.168 177.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -67.35 -38.1 84.29 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.574 -0.528 . . . . 1.26 109.574 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.5 mp -65.94 -35.48 80.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.493 -0.776 . . . . 0.20000000000000001 110.624 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 206' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.6 mt-10 -64.66 -48.68 73.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.794 0.33 . . . . 1.1399999999999999 110.423 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 48.7 mt-30 -65.72 -41.65 92.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 1.1299999999999999 111.564 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.59 -50.8 16.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.505 . . . . 1.98 111.431 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.0 mp -78.27 -22.19 48.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.45000000000000001 112.089 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.64 16.09 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.907 0.755 . . . . 2.1899999999999999 110.549 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.33 119.02 3.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 1.1100000000000001 110.393 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -68.65 -37.64 79.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.831 -0.622 . . . . 1.4099999999999999 111.557 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.0 -49.63 71.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.839 0.352 . . . . 2.0 111.035 -175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -68.83 -30.82 69.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.957 -0.565 . . . . 1.48 110.045 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.15 84.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.765 -0.652 . . . . 0.20999999999999999 110.092 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.457 ' O ' HG23 ' B' ' 220' ' ' VAL . 59.8 t30 -69.17 -44.59 71.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.499 -0.773 . . . . 0.63 109.985 177.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.15 -41.31 83.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 1.97 111.001 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.465 HD12 HD21 ' B' ' 209' ' ' LEU . 40.1 mt -73.21 -36.62 66.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.063 -0.517 . . . . 0.20000000000000001 110.682 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -60.0 -43.4 95.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.992 0.425 . . . . 1.29 110.218 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.6 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 62.0 t -70.6 -46.95 67.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 0.19 109.539 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.0 -48.87 78.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.924 -1.035 . . . . 0.25 110.855 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -67.82 -37.07 81.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.467 -0.788 . . . . 1.24 110.554 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.5 tttt -68.19 -34.24 75.93 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.068 -0.253 . . . . 0.34999999999999998 110.936 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 52.3 mm-40 -75.25 -29.27 60.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.467 0.651 . . . . 2.27 109.675 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 225' ' ' ALA . . . -67.94 -40.34 83.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.232 174.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.5 t90 -65.39 -38.58 90.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.019 -0.992 . . . . 0.19 109.933 177.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 40.5 mmt180 -58.99 -41.06 86.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 2.25 110.372 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.5 m -73.73 -10.12 59.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.077 -0.51 . . . . 1.1799999999999999 111.501 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 16.8 t -74.75 -13.65 60.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.975 0.417 . . . . 0.93000000000000005 110.512 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.687 -0.673 . . . . 1.27 110.358 178.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 N--CA 1.479 0.629 0 N-CA-C 110.635 -0.563 . . . . 1.9099999999999999 110.635 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 51.1 m -114.66 53.29 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.397 0.618 . . . . 2.1000000000000001 110.7 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.511 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 69.09 63.96 3.21 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.303 -0.862 . . . . 1.6699999999999999 113.889 176.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -165.22 -65.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 117.098 0.449 . . . . 1.96 111.025 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 12.8 m -56.41 -45.73 80.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 1.24 111.096 -175.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 CA-C-N 116.359 -0.382 . . . . 0.34999999999999998 110.856 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.408 HG13 ' CE2' ' A' ' 197' ' ' PHE . 19.4 t -69.22 -20.16 24.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.457 0.646 . . . . 0.23999999999999999 110.018 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.411 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -89.0 11.63 17.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.898 -0.592 . . . . 0.23999999999999999 111.458 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 49.1 p -106.51 158.56 16.83 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.601 -0.44 . . . . 0.26000000000000001 110.764 -175.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.04 -39.14 89.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.863 -0.608 . . . . 2.46 109.615 175.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.97 -38.45 76.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.131 -0.94 . . . . 0.26000000000000001 112.292 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' PHE . . . . . 0.408 ' CE2' HG13 ' A' ' 192' ' ' VAL . 76.4 t80 -63.25 -51.31 66.71 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.749 -0.381 . . . . 0.22 110.348 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 198' ' ' TRP . . . . . 0.401 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 95.4 m95 -70.09 -29.13 66.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.803 -0.635 . . . . 0.17000000000000001 111.505 -178.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -64.14 -52.02 61.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.135 -0.484 . . . . 1.23 110.413 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -71.61 -32.39 67.96 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 1.3700000000000001 111.09 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.72 -46.75 86.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.171 -0.677 . . . . 0.17999999999999999 109.171 175.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.27 -37.31 86.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.70999999999999996 110.601 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.7 -39.52 95.35 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.938 -0.649 . . . . 0.16 112.142 176.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -66.14 -40.25 90.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.473 0.654 . . . . 1.26 109.294 177.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.9 mp -64.53 -34.28 77.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.07 -0.968 . . . . 0.19 110.487 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.66 -45.93 84.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.738 0.304 . . . . 1.1299999999999999 110.419 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.6 mt-30 -58.93 -47.54 84.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 1.1299999999999999 111.831 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.63 -45.41 17.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.236 -0.438 . . . . 1.97 112.136 -174.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.8 mp -82.16 -23.01 35.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.45000000000000001 112.004 -172.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 56.81 37.24 28.67 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 123.969 0.793 . . . . 2.1899999999999999 110.427 -176.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -156.47 110.3 2.71 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.566 -0.743 . . . . 1.1200000000000001 109.8 -177.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.78 -34.16 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 1.4199999999999999 111.222 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.27 -50.83 64.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.417 -0.356 . . . . 2.0099999999999998 111.25 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.75 -27.95 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.422 . . . . 1.48 110.02 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.49 -37.21 84.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.493 0.663 . . . . 0.20000000000000001 109.526 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 63.1 t30 -70.21 -46.63 64.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.274 -0.876 . . . . 0.63 110.121 178.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -58.27 -39.7 79.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.729 -0.669 . . . . 1.99 111.077 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.544 HD12 HD21 ' A' ' 209' ' ' LEU . 33.5 mt -73.67 -36.29 65.31 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.183 -0.462 . . . . 0.20000000000000001 110.653 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -57.66 -43.62 85.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.171 0.51 . . . . 1.29 110.007 177.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 58.8 t -71.38 -49.29 48.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.401 -0.818 . . . . 0.19 109.764 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.501 HD21 ' O ' ' B' ' 225' ' ' ALA . 56.6 tp -57.14 -48.2 79.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.867 -1.06 . . . . 0.26000000000000001 110.994 -177.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.39 -37.42 86.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.598 -0.728 . . . . 1.25 110.409 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.9 tttt -66.25 -33.64 76.21 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.836 -0.346 . . . . 0.35999999999999999 110.726 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.71 64.7 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.521 -0.548 . . . . 2.2799999999999998 109.521 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 225' ' ' ALA . . . . . 0.467 ' O ' HD21 ' B' ' 221' ' ' LEU . . . -68.29 -42.17 79.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.374 -0.83 . . . . 0.16 109.672 176.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.411 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -63.69 -39.03 93.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.276 -0.875 . . . . 0.19 110.131 177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 227' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.6 mmm180 -64.12 -34.4 77.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.312 -0.403 . . . . 2.25 110.351 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -77.37 -7.35 55.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.526 -0.306 . . . . 1.1599999999999999 111.032 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 32.4 t -75.21 -17.16 60.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.53 0.681 . . . . 0.93000000000000005 109.563 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.413 -0.803 . . . . 1.27 109.684 176.966 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.477 0.516 0 N-CA-C 110.483 -0.622 . . . . 1.8899999999999999 110.483 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 50.1 m -114.51 52.88 0.82 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.484 0.659 . . . . 2.1000000000000001 110.816 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.496 ' HA2' ' HG ' ' A' ' 209' ' ' LEU . . . 69.28 63.77 3.27 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.197 -0.911 . . . . 1.6799999999999999 113.874 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -164.99 -65.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.084 0.442 . . . . 1.97 111.111 177.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 11.4 m -56.8 -45.5 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.06 -0.518 . . . . 1.24 111.146 -175.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.64 -36.37 77.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.368 -0.378 . . . . 0.34000000000000002 110.816 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.414 HG22 HD11 ' A' ' 209' ' ' LEU . 19.2 t -68.98 -20.37 24.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.529 0.68 . . . . 0.23000000000000001 110.002 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.42 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -89.05 11.54 18.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.876 -0.602 . . . . 0.23000000000000001 111.52 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 50.1 p -106.52 158.65 16.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.93 0.395 . . . . 0.25 110.577 -175.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -65.97 -39.27 90.24 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.497 -0.557 . . . . 2.46 109.497 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.86 -38.65 76.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.157 -0.928 . . . . 0.27000000000000002 112.36 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 197' ' ' PHE . . . . . 0.402 ' CE2' HG13 ' B' ' 192' ' ' VAL . 75.7 t80 -63.33 -51.2 66.97 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.714 -0.394 . . . . 0.22 110.332 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -70.09 -29.07 65.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.926 -0.579 . . . . 0.16 111.502 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.21 -52.11 60.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.458 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -71.66 -32.28 67.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.138 -0.483 . . . . 1.3700000000000001 111.018 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.7 -46.69 86.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.255 -0.646 . . . . 0.17000000000000001 109.255 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.26 -37.19 86.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.856 -0.611 . . . . 0.70999999999999996 110.618 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' GLY . . . . . 0.451 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.0 -39.1 95.21 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.994 -0.622 . . . . 0.16 112.163 176.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -66.4 -40.26 89.52 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.535 0.683 . . . . 1.26 109.4 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.8 mp -64.68 -34.27 77.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.106 -0.952 . . . . 0.20000000000000001 110.516 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.49 -46.24 83.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.772 0.32 . . . . 1.1399999999999999 110.271 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 207' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 53.4 mt-30 -58.9 -47.37 85.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.554 . . . . 1.1299999999999999 111.8 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.77 -45.4 17.06 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.163 0.431 . . . . 1.98 112.163 -174.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.7 mp -82.14 -22.97 35.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.259 -0.428 . . . . 0.45000000000000001 112.045 -172.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.78 37.45 28.81 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.987 0.804 . . . . 2.1899999999999999 110.398 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -156.71 109.92 2.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.472 -0.786 . . . . 1.1100000000000001 109.845 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -67.53 -34.23 76.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.012 -0.54 . . . . 1.4099999999999999 111.285 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.22 -50.93 63.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.51 -0.314 . . . . 2.0 111.098 -176.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -70.81 -27.76 64.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.019 0.438 . . . . 1.48 110.049 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.56 -37.26 84.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.583 0.706 . . . . 0.20999999999999999 109.594 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.447 ' O ' HG23 ' B' ' 220' ' ' VAL . 62.6 t30 -70.08 -46.86 64.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.185 -0.916 . . . . 0.63 110.124 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -57.85 -40.15 79.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.714 -0.676 . . . . 1.97 111.116 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.527 HD12 HD21 ' B' ' 209' ' ' LEU . 32.9 mt -73.4 -36.3 66.0 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.179 -0.464 . . . . 0.20000000000000001 110.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -57.73 -43.49 85.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.152 0.501 . . . . 1.29 110.06 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.579 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 60.5 t -71.43 -49.33 47.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.457 -0.792 . . . . 0.19 109.798 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 221' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 225' ' ' ALA . 56.7 tp -56.98 -48.16 79.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.968 -1.014 . . . . 0.25 111.061 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.5 -37.56 87.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.581 -0.736 . . . . 1.24 110.235 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 223' ' ' LYS . . . . . 0.538 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.0 tttt -65.99 -33.84 76.72 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.86 -0.336 . . . . 0.34999999999999998 110.707 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.579 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.63 64.65 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.556 -0.535 . . . . 2.27 109.556 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 225' ' ' ALA . . . . . 0.501 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -68.38 -42.19 79.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.394 -0.821 . . . . 0.16 109.602 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.42 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.8 t90 -63.68 -38.93 92.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.285 -0.87 . . . . 0.19 110.249 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 227' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.5 mmm180 -64.24 -34.43 78.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 2.25 110.397 176.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.1 t -77.48 -6.86 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.444 -0.344 . . . . 1.1799999999999999 111.147 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 31.6 t -75.52 -16.9 60.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.452 -0.573 . . . . 0.93000000000000005 109.452 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.419 -0.801 . . . . 1.27 109.966 176.98 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo . . . . . 0 N--CA 1.48 0.694 0 N-CA-C 110.411 -0.65 . . . . 1.9099999999999999 110.411 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.2 m -127.88 61.12 1.43 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.298 0.571 . . . . 2.1000000000000001 110.341 177.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.459 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 65.48 62.07 5.14 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.412 -0.813 . . . . 1.6699999999999999 114.377 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -164.29 -72.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 117.152 0.476 . . . . 1.96 110.96 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 26.4 t -51.23 -47.62 62.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.408 -0.36 . . . . 1.24 111.637 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.6 -33.16 58.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.553 0.216 . . . . 0.34999999999999998 111.122 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.439 HG13 ' CE2' ' A' ' 197' ' ' PHE . 44.0 t -69.14 -22.55 26.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.405 0.622 . . . . 0.23999999999999999 110.183 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -86.16 12.36 9.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.837 -0.62 . . . . 0.23999999999999999 111.756 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 36.9 p -108.43 155.32 20.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.013 0.435 . . . . 0.26000000000000001 110.844 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -65.37 -32.97 74.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.75 -0.659 . . . . 2.46 109.262 174.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.01 -41.88 88.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.035 -0.984 . . . . 0.26000000000000001 111.982 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' PHE . . . . . 0.446 ' CE1' HD11 ' B' ' 209' ' ' LEU . 54.2 t80 -64.3 -50.35 68.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.726 -0.39 . . . . 0.22 110.557 -179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.1 -28.5 66.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.071 -0.513 . . . . 0.17000000000000001 110.97 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -63.74 -49.7 72.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.998 -0.547 . . . . 1.23 110.433 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -70.94 -34.09 71.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.207 -0.452 . . . . 1.3700000000000001 110.929 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 205' ' ' LEU . 2.9 tm? -60.21 -48.04 83.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.957 -0.565 . . . . 0.17999999999999999 109.739 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.442 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 47.1 tt0 -68.8 -34.7 75.96 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.677 -0.409 . . . . 0.70999999999999996 110.364 176.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.09 95.41 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.16 111.773 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -67.62 -38.39 83.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 4.9 mp -66.03 -37.35 85.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.832 -0.622 . . . . 0.19 110.608 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -64.09 -47.36 80.35 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.713 0.292 . . . . 1.1299999999999999 110.552 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -66.85 -43.23 84.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.177 -0.465 . . . . 1.1299999999999999 111.77 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 8.7 tpt85 -75.15 -48.44 23.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.915 0.388 . . . . 1.97 111.308 -175.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -77.24 -22.07 52.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.912 -0.585 . . . . 0.45000000000000001 112.172 -176.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 63.11 32.46 15.21 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 124.131 0.895 . . . . 2.1899999999999999 110.509 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.17 118.69 4.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 1.1200000000000001 110.426 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -67.96 -40.06 83.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 1.4199999999999999 112.085 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -62.2 -51.37 68.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.591 -0.277 . . . . 2.0099999999999998 111.16 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 10.0 tp10 -70.73 -28.26 64.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.358 -0.383 . . . . 1.48 110.462 -177.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.58 -40.86 84.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.423 0.63 . . . . 0.20000000000000001 109.975 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.423 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.2 t-20 -69.05 -45.53 70.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.122 -0.944 . . . . 0.63 109.78 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.55 -40.49 87.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.364 -0.835 . . . . 1.99 111.149 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 218' ' ' LEU . . . . . 0.472 HD12 HD21 ' A' ' 209' ' ' LEU . 45.6 mt -72.77 -36.87 67.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.406 -0.361 . . . . 0.20000000000000001 110.238 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 219' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 40.6 ttp180 -56.43 -42.13 77.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.213 0.53 . . . . 1.29 110.172 175.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.589 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 99.5 t -71.33 -49.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.665 -0.698 . . . . 0.19 109.925 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 50.2 tp -56.63 -49.7 74.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.922 -1.036 . . . . 0.26000000000000001 111.095 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -64.61 -36.93 85.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.224 -0.898 . . . . 1.25 110.491 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -68.57 -29.87 68.52 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.739 -0.384 . . . . 0.35999999999999999 111.018 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 48.6 mt-10 -73.23 -33.78 65.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.311 -0.626 . . . . 2.2799999999999998 109.311 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.82 -40.29 79.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.41 -0.813 . . . . 0.16 109.835 177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 58.1 t90 -65.13 -41.94 94.35 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.126 -0.943 . . . . 0.19 110.148 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -63.97 -37.98 89.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.043 -0.526 . . . . 2.25 111.089 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 43.4 m -73.71 -5.22 39.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.768 0.318 . . . . 1.1599999999999999 111.641 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 64.0 m -85.75 -9.46 57.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.181 0.515 . . . . 0.93000000000000005 110.412 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.685 -0.674 . . . . 1.27 109.748 176.901 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo . . . . . 0 N--CA 1.479 0.635 0 N-CA-C 110.26 -0.708 . . . . 1.8899999999999999 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 21.9 m -127.81 60.9 1.43 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.34 0.591 . . . . 2.1000000000000001 110.372 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.524 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 65.62 62.23 4.98 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.37 -0.832 . . . . 1.6799999999999999 114.323 177.068 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -164.32 -72.21 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.145 0.472 . . . . 1.97 110.963 172.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 25.9 t -51.08 -47.81 61.77 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.289 0.368 . . . . 1.24 111.632 -177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 191' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.6 p -68.53 -32.95 57.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.657 0.265 . . . . 0.34000000000000002 111.092 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.432 HG13 ' CE2' ' B' ' 197' ' ' PHE . 43.6 t -69.24 -22.64 26.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.264 0.554 . . . . 0.23000000000000001 110.256 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.403 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.29 12.14 10.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.867 -0.606 . . . . 0.23000000000000001 111.625 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 35.8 p -108.15 155.31 20.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.917 0.389 . . . . 0.25 110.753 -175.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.38 -32.99 74.92 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.238 -0.653 . . . . 2.46 109.238 174.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.98 88.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.141 -0.936 . . . . 0.27000000000000002 111.83 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 197' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 209' ' ' LEU . 54.4 t80 -64.18 -50.43 68.15 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.658 -0.417 . . . . 0.22 110.565 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.13 -28.36 66.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.1 -0.5 . . . . 0.16 110.972 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -63.76 -49.86 71.34 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 1.25 110.481 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.84 -34.02 71.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.284 -0.417 . . . . 1.3700000000000001 110.867 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 201' ' ' LEU . . . . . 0.412 ' O ' HD13 ' B' ' 205' ' ' LEU . 2.9 tm? -60.15 -48.01 83.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.17000000000000001 109.726 177.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.466 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 47.3 tt0 -68.81 -35.09 76.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.407 -0.36 . . . . 0.70999999999999996 110.399 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -57.95 -41.97 94.58 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.827 -0.701 . . . . 0.16 111.742 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.96 -38.04 82.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.722 -0.473 . . . . 1.26 109.722 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 4.9 mp -66.44 -37.17 84.58 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.862 -0.608 . . . . 0.20000000000000001 110.652 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -63.96 -47.81 78.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.781 0.324 . . . . 1.1399999999999999 110.532 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -66.43 -43.22 86.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 1.1299999999999999 111.878 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -75.18 -48.45 23.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.831 0.348 . . . . 1.98 111.295 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.9 mp -77.34 -21.88 52.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.98 -0.555 . . . . 0.45000000000000001 112.171 -176.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 62.85 32.48 15.8 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 124.135 0.897 . . . . 2.1899999999999999 110.593 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -155.15 118.57 4.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 1.1100000000000001 110.285 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.86 -40.07 83.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.953 -0.567 . . . . 1.4099999999999999 112.069 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -62.23 -51.13 69.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.648 0.261 . . . . 2.0 111.191 -174.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 214' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 9.2 tp10 -71.01 -28.17 64.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.886 0.374 . . . . 1.48 110.422 -177.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.54 -41.01 84.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.506 0.669 . . . . 0.20999999999999999 109.958 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.422 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.4 t-20 -69.13 -45.55 69.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.095 -0.957 . . . . 0.63 109.757 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.39 -40.42 86.54 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.404 -0.816 . . . . 1.97 111.245 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 218' ' ' LEU . . . . . 0.478 HD12 HD21 ' B' ' 209' ' ' LEU . 45.5 mt -72.79 -36.87 67.68 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.336 -0.393 . . . . 0.20000000000000001 110.284 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 219' ' ' ARG . . . . . 0.466 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 40.8 ttp180 -56.46 -42.21 77.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.18 0.514 . . . . 1.29 110.125 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.578 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 97.2 t -71.28 -49.66 46.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.634 -0.712 . . . . 0.19 109.969 -178.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 50.0 tp -56.62 -49.43 75.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.908 -1.042 . . . . 0.25 111.115 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -64.8 -37.3 87.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.201 -0.909 . . . . 1.24 110.324 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -68.3 -30.06 68.96 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.758 -0.377 . . . . 0.34999999999999998 110.908 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 48.3 mt-10 -73.22 -33.24 65.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.415 -0.587 . . . . 2.27 109.415 178.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.17 77.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.399 -0.818 . . . . 0.16 109.701 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.403 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 58.4 t90 -65.32 -41.85 93.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.187 177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -64.13 -37.81 88.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.53 . . . . 2.25 111.146 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 43.8 m -73.99 -4.74 37.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.508 -0.314 . . . . 1.1799999999999999 111.693 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 66.3 m -85.88 -9.79 56.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.118 0.485 . . . . 0.93000000000000005 110.426 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.553 -0.737 . . . . 1.27 109.917 177.05 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.476 0.486 0 N-CA-C 110.418 -0.647 . . . . 1.9099999999999999 110.418 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 8.2 p -94.23 -4.19 49.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.945 0.403 . . . . 2.1000000000000001 111.617 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' GLY . . . . . 0.498 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 96.22 73.63 1.17 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.676 -0.773 . . . . 1.6699999999999999 113.716 173.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -171.68 -59.07 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.995 -0.372 . . . . 1.96 109.995 173.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.9 t -58.21 -40.15 80.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.106 -0.497 . . . . 1.24 110.65 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.0 p -70.59 -33.92 55.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-O 120.82 0.343 . . . . 0.34999999999999998 110.78 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' VAL . . . . . 0.455 HG13 ' CE2' ' A' ' 197' ' ' PHE . 39.0 t -71.48 -19.75 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.704 0.764 . . . . 0.23999999999999999 109.679 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' ALA . . . . . 0.468 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.14 11.59 11.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.468 -0.787 . . . . 0.23999999999999999 111.466 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.9 p -106.02 151.22 24.92 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.26000000000000001 110.193 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -65.76 -32.9 74.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.7 -0.682 . . . . 2.46 109.304 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.55 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.925 -1.034 . . . . 0.26000000000000001 111.782 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' PHE . . . . . 0.455 ' CE2' HG13 ' A' ' 192' ' ' VAL . 57.1 t80 -62.22 -50.23 72.59 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.737 0.303 . . . . 0.22 110.244 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -68.75 -28.86 67.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.785 -0.643 . . . . 0.17000000000000001 111.51 -177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.94 -47.82 73.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.68 0.276 . . . . 1.23 110.386 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -66.64 -37.44 84.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.956 0.407 . . . . 1.3700000000000001 110.598 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.89 -47.69 84.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.757 . . . . 0.17999999999999999 109.867 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' GLN . . . . . 0.548 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 53.1 tt0 -69.04 -31.88 70.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.341 -0.391 . . . . 0.70999999999999996 110.478 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.78 -41.34 99.61 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.16 111.509 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.0 -37.84 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.68 -0.489 . . . . 1.26 109.68 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.0 mp -66.78 -35.97 81.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.676 -0.693 . . . . 0.19 110.793 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.02 -46.95 82.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.77 0.319 . . . . 1.1299999999999999 110.677 176.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -66.62 -41.46 88.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.094 -0.503 . . . . 1.1299999999999999 111.768 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.0 tpt85 -74.69 -48.99 22.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.893 0.377 . . . . 1.97 111.387 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -80.73 -22.58 40.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.659 0.614 . . . . 0.45000000000000001 112.659 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 14.4 mptt 62.99 35.09 13.46 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.679 0.612 . . . . 2.1899999999999999 110.626 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -156.61 118.95 3.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.058 0.456 . . . . 1.1200000000000001 110.592 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -67.97 -40.12 83.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.511 -0.768 . . . . 1.4199999999999999 111.818 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 217' ' ' LYS . 6.5 m-20 -62.46 -51.34 67.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.377 . . . . 2.0099999999999998 111.307 -173.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 214' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 23.4 tp10 -70.81 -31.06 67.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.919 0.39 . . . . 1.48 110.313 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.61 -39.44 91.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.20000000000000001 110.132 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -70.29 -47.36 61.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.63 110.1 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 217' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 213' ' ' ASP . 68.0 mttm -60.91 -37.01 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.775 -0.648 . . . . 1.99 111.094 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 44.4 mt -72.48 -39.97 67.28 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.306 -0.407 . . . . 0.20000000000000001 110.271 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' ARG . . . . . 0.548 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 37.2 ttp180 -55.16 -42.31 72.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.142 0.496 . . . . 1.29 110.288 176.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 220' ' ' VAL . . . . . 0.635 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 85.9 t -71.13 -49.56 47.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.558 -0.746 . . . . 0.19 109.851 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.89 -48.5 78.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.937 -1.029 . . . . 0.26000000000000001 111.025 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.14 -36.96 85.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 1.25 110.317 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -67.46 -31.73 72.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.35999999999999999 110.846 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 44.3 mt-10 -75.42 -31.48 60.39 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.466 -0.568 . . . . 2.2799999999999998 109.466 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.15 -41.63 77.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.428 -0.806 . . . . 0.16 109.662 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 226' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 56.0 t90 -64.38 -37.74 88.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.165 -0.925 . . . . 0.19 110.1 177.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.77 -35.0 79.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.227 -0.442 . . . . 2.25 110.756 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 19.7 t -74.95 -9.68 58.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.938 0.399 . . . . 1.1599999999999999 110.923 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 23.2 t -75.42 -12.51 60.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.166 0.508 . . . . 0.93000000000000005 110.229 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.651 -0.69 . . . . 1.27 110.327 178.773 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.476 0.497 0 N-CA-C 110.379 -0.662 . . . . 1.8899999999999999 110.379 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 7.7 p -94.15 -4.29 49.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.831 0.348 . . . . 2.1000000000000001 111.716 177.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.437 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 96.14 73.68 1.18 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.676 -0.773 . . . . 1.6799999999999999 113.556 173.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -171.3 -59.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.851 0.358 . . . . 1.97 110.045 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -39.99 80.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.24 110.721 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.59 -34.18 56.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.34000000000000002 110.809 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 192' ' ' VAL . . . . . 0.458 HG13 ' CE2' ' B' ' 197' ' ' PHE . 39.1 t -71.38 -19.63 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.688 0.756 . . . . 0.23000000000000001 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 193' ' ' ALA . . . . . 0.466 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.15 11.57 11.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.431 -0.804 . . . . 0.23000000000000001 111.642 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.6 p -106.05 151.35 24.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.022 0.439 . . . . 0.25 110.165 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.99 -32.88 74.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.637 -0.71 . . . . 2.46 109.245 175.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.68 92.76 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.873 -1.058 . . . . 0.27000000000000002 111.691 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 197' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' B' ' 192' ' ' VAL . 56.0 t80 -62.25 -50.26 72.44 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.894 0.378 . . . . 0.22 110.093 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.7 -28.91 67.26 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.624 -0.716 . . . . 0.16 111.558 -177.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.88 -47.9 73.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.722 0.296 . . . . 1.25 110.38 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -66.39 -37.71 85.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.995 0.426 . . . . 1.3700000000000001 110.387 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.74 -47.8 84.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.655 -0.702 . . . . 0.17000000000000001 109.931 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.543 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 53.6 tt0 -68.95 -31.81 70.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.369 -0.378 . . . . 0.70999999999999996 110.5 178.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.82 -41.45 99.63 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.749 -0.739 . . . . 0.16 111.512 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.8 -38.0 85.64 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.691 -0.485 . . . . 1.26 109.691 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.0 mp -66.63 -36.03 81.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.20000000000000001 110.806 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -64.03 -46.76 83.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.82 0.343 . . . . 1.1399999999999999 110.6 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.8 -41.25 87.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 1.1299999999999999 111.926 -178.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -74.87 -49.11 21.59 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.833 0.349 . . . . 1.98 111.292 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 209' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.0 mp -80.67 -22.66 40.24 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.524 0.564 . . . . 0.45000000000000001 112.524 -175.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 14.3 mptt 62.95 34.98 13.66 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.658 0.599 . . . . 2.1899999999999999 110.717 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -156.56 118.86 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.076 0.465 . . . . 1.1100000000000001 110.536 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -67.97 -40.26 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.551 -0.749 . . . . 1.4099999999999999 111.866 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.12 -51.44 67.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 2.0 111.34 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 22.0 tp10 -70.8 -31.04 67.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.923 0.392 . . . . 1.48 110.274 -178.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.69 -39.4 91.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.412 0.625 . . . . 0.20999999999999999 110.025 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 216' ' ' ASN . . . . . 0.464 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.3 t-20 -70.25 -47.45 61.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.208 -0.905 . . . . 0.63 110.099 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.9 -37.04 80.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.77 -0.65 . . . . 1.97 111.013 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.1 mt -72.43 -40.01 67.42 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.325 -0.398 . . . . 0.20000000000000001 110.203 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 219' ' ' ARG . . . . . 0.543 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 36.9 ttp180 -55.14 -42.18 72.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.088 0.47 . . . . 1.29 110.299 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 220' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 79.0 t -71.27 -49.59 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.19 109.816 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 60.7 tp -56.73 -48.73 77.11 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.961 -1.018 . . . . 0.25 111.039 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.01 -37.01 86.23 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.462 -0.79 . . . . 1.24 110.291 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.32 -31.96 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.012 -0.275 . . . . 0.34999999999999998 110.801 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 224' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 43.8 mt-10 -75.21 -31.65 60.95 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.525 -0.546 . . . . 2.27 109.525 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.87 -41.68 78.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.523 -0.762 . . . . 0.16 109.65 175.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 226' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 56.3 t90 -64.39 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.251 -0.886 . . . . 0.19 110.132 177.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.9 -34.87 78.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 2.25 110.658 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 24.2 t -74.63 -10.26 59.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.8 0.333 . . . . 1.1799999999999999 110.891 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.1 t -75.24 -12.56 60.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.181 0.515 . . . . 0.93000000000000005 110.371 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.636 -0.697 . . . . 1.27 110.467 178.667 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.542 0.211 . . . . 1.24 110.954 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.29 -33.92 47.65 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-O 120.779 0.323 . . . . 0.35 110.377 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.476 HG22 HD11 ' B' ' 209' ' ' LEU . 22.3 t -69.89 -19.69 22.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.678 0.751 . . . . 0.24 109.73 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.515 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.21 12.04 10.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.546 -0.752 . . . . 0.24 111.522 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 34.1 p -108.98 146.28 34.12 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.485 0.66 . . . . 0.26 110.562 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.95 -31.57 72.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 2.46 110.012 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.18 -40.5 94.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.4 -0.818 . . . . 0.26 111.427 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.14 -49.98 73.69 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.338 -0.392 . . . . 0.22 109.943 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.82 -29.22 67.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.61 -0.723 . . . . 0.17 111.845 -177.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.38 -48.3 70.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.799 0.333 . . . . 1.23 110.232 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.32 -33.84 73.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 1.37 110.928 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.14 -47.13 86.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.921 -0.581 . . . . 0.18 109.609 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.445 ' HB2' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.6 -32.19 72.76 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.438 -0.347 . . . . 0.71 110.2 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.02 -41.7 96.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.959 -0.639 . . . . 0.16 111.735 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.14 -41.13 90.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.441 0.638 . . . . 1.26 109.534 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.425 HD23 ' HB2' ' A' ' 218' ' ' LEU . 3.0 mp -63.59 -37.93 89.21 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.094 -0.957 . . . . 0.19 110.434 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -66.76 -42.88 85.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.66 -0.245 . . . . 1.13 110.664 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 49.7 mt-30 -57.51 -46.07 84.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.878 0.37 . . . . 1.13 111.567 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.96 -41.32 20.97 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.484 0.55 . . . . 1.97 112.484 -175.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.47 HD11 HG22 ' B' ' 192' ' ' VAL . 8.3 mp -86.26 -22.46 26.83 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.049 0.389 . . . . 0.45 112.049 -172.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.53 39.61 17.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.622 -0.717 . . . . 2.19 110.991 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -157.99 117.33 3.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.955 0.407 . . . . 1.12 110.221 -177.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.58 -44.29 82.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.569 -0.741 . . . . 1.42 111.778 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -69.72 -40.67 76.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.532 -0.304 . . . . 2.01 111.142 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -68.31 -40.21 81.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.329 0.585 . . . . 1.48 109.866 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.54 -32.71 74.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.403 -0.817 . . . . 0.2 109.887 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.9 t-20 -69.76 -44.22 70.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.996 -1.002 . . . . 0.63 110.006 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -56.58 -42.65 79.03 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.389 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.425 ' HB2' HD23 ' A' ' 205' ' ' LEU . 53.7 mt -72.84 -35.18 67.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.656 -0.702 . . . . 0.2 110.502 -177.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 202' ' ' GLN . 50.2 ttp180 -57.89 -42.99 85.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.03 0.443 . . . . 1.29 110.271 176.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 60.5 t -71.23 -49.08 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.639 -0.71 . . . . 0.19 109.806 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.409 HD21 ' O ' ' B' ' 225' ' ' ALA . 65.2 tp -57.36 -49.52 75.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.701 -1.136 . . . . 0.26 110.964 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -66.3 -36.92 84.19 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.778 -0.647 . . . . 1.25 110.706 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 88.0 tttt -66.71 -34.54 78.08 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.67 -0.412 . . . . 0.36 110.824 179.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 10.9 mm-40 -75.79 -30.49 59.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.135 0.493 . . . . 2.28 109.822 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.37 -42.94 82.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.592 -0.731 . . . . 0.16 109.482 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 36.6 t90 -63.28 -36.2 82.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.121 -0.945 . . . . 0.19 110.096 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.572 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.7 82.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.263 -0.426 . . . . 2.25 110.626 175.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 14.5 t -76.61 -9.29 58.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.201 -0.454 . . . . 1.16 110.785 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 35.1 t -75.19 -12.03 60.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.193 0.52 . . . . 0.93 110.348 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.695 -0.669 . . . . 1.27 110.355 178.07 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.569 0.223 . . . . 1.24 110.834 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.13 -33.99 48.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 CA-C-O 120.721 0.296 . . . . 0.34 110.269 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.47 HG22 HD11 ' A' ' 209' ' ' LEU . 22.2 t -69.82 -19.68 22.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.573 0.701 . . . . 0.23 109.736 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.518 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.16 11.84 11.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.623 -0.717 . . . . 0.23 111.486 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 34.4 p -108.87 146.17 34.15 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.572 0.701 . . . . 0.25 110.457 -175.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.79 -31.72 72.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.768 -1.105 . . . . 2.46 109.939 176.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.1 -40.29 93.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.518 -0.764 . . . . 0.27 111.487 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.34 -50.1 72.97 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.332 -0.395 . . . . 0.22 109.991 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.71 -29.29 67.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.594 -0.73 . . . . 0.16 111.861 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.3 -48.48 70.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.8 0.333 . . . . 1.25 110.155 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.16 -33.95 74.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.378 -0.374 . . . . 1.37 110.784 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -58.99 -47.16 86.18 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.003 -0.544 . . . . 0.17 109.589 175.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.433 ' HB2' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.67 -32.07 72.48 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 116.459 -0.337 . . . . 0.71 110.328 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.628 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.25 -41.55 96.83 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.968 -0.634 . . . . 0.16 111.594 175.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -66.21 -41.12 90.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.413 0.625 . . . . 1.26 109.509 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.415 HD23 ' HB2' ' B' ' 218' ' ' LEU . 3.0 mp -63.49 -38.06 89.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.108 -0.951 . . . . 0.2 110.54 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -66.64 -43.16 85.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.672 -0.24 . . . . 1.14 110.552 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.628 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 49.7 mt-30 -57.21 -46.13 83.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.429 -0.35 . . . . 1.13 111.588 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -82.09 -41.17 20.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.425 0.528 . . . . 1.98 112.425 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.476 HD11 HG22 ' A' ' 192' ' ' VAL . 8.4 mp -86.26 -22.68 26.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.982 0.364 . . . . 0.45 111.982 -172.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.45 40.07 17.63 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.909 0.756 . . . . 2.19 110.758 -177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -158.2 117.37 3.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.888 0.375 . . . . 1.11 110.319 -177.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -66.6 -44.28 82.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.604 -0.726 . . . . 1.41 111.801 -177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.75 -41.05 75.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.445 -0.343 . . . . 2.0 111.045 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -67.98 -40.28 83.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.437 0.637 . . . . 1.48 110.002 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.8 74.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 0.21 109.915 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.414 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.56 -44.57 70.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.107 -0.952 . . . . 0.63 110.028 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -56.23 -42.93 78.08 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 116.137 -0.483 . . . . 1.97 110.377 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.415 ' HB2' HD23 ' B' ' 205' ' ' LEU . 54.2 mt -72.77 -35.04 67.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.689 -0.687 . . . . 0.2 110.578 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . 0.433 ' HD3' ' HB2' ' B' ' 202' ' ' GLN . 50.1 ttp180 -57.83 -43.2 85.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.101 0.477 . . . . 1.29 110.18 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 59.6 t -71.16 -49.07 51.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.708 -0.678 . . . . 0.19 109.891 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.3 tp -57.23 -49.75 75.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.756 -1.111 . . . . 0.25 111.035 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -66.24 -36.79 83.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.76 -0.654 . . . . 1.24 110.731 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.557 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 87.9 tttt -66.84 -34.5 77.95 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.663 -0.415 . . . . 0.35 110.795 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 12.0 mm-40 -75.75 -30.2 59.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.095 0.474 . . . . 2.27 109.796 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -67.64 -42.87 81.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.539 -0.755 . . . . 0.16 109.458 174.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.518 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 36.9 t90 -63.33 -36.23 82.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.207 -0.906 . . . . 0.19 110.151 176.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.99 82.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 2.25 110.386 175.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 19.5 t -76.36 -9.15 58.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.261 -0.427 . . . . 1.18 110.871 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 33.5 t -75.35 -11.81 60.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.057 0.456 . . . . 0.93 110.313 178.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.606 -0.711 . . . . 1.27 110.406 177.712 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 113.28 0.844 . . . . 1.24 113.28 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 14.8 p -86.74 -31.41 6.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.284 -0.567 . . . . 0.35 111.009 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.461 HG22 HD11 ' B' ' 209' ' ' LEU . 28.1 t -68.28 -21.38 26.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.366 0.603 . . . . 0.24 110.231 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.46 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.28 11.36 12.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.99 -0.55 . . . . 0.24 111.354 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 46.1 p -106.32 145.66 31.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.279 0.561 . . . . 0.26 109.998 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -65.45 -32.4 74.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.189 -0.914 . . . . 2.46 109.692 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.76 -37.87 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.366 -0.833 . . . . 0.26 111.745 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -62.68 -50.8 69.72 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.967 -0.383 . . . . 0.22 109.967 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.18 -29.38 67.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.635 -0.711 . . . . 0.17 111.553 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.88 -48.75 70.49 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.028 0.442 . . . . 1.23 110.316 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -72.45 -32.54 66.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 1.37 110.938 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.46 -47.1 85.13 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.037 -0.727 . . . . 0.18 109.037 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.46 ' HB2' ' HD2' ' A' ' 219' ' ' ARG . 49.8 tt0 -66.05 -33.84 76.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.145 -0.479 . . . . 0.71 110.299 176.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.493 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -61.41 -39.82 97.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.829 -0.701 . . . . 0.16 112.068 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.45 -38.64 87.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.542 0.687 . . . . 1.26 109.258 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -65.55 -33.6 76.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.686 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.01 -43.63 87.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.869 0.366 . . . . 1.13 110.476 175.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 51.4 mt-30 -59.99 -46.99 87.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.989 -0.551 . . . . 1.13 111.532 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 208' ' ' ARG . 9.7 mmt180 -79.29 -47.02 16.6 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.431 0.53 . . . . 1.97 112.431 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.49 HD21 HD12 ' A' ' 218' ' ' LEU . 8.7 mp -81.87 -21.95 37.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.346 -0.388 . . . . 0.45 111.858 -172.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.56 35.31 20.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 2.19 110.658 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -157.93 118.79 3.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 1.12 110.128 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -68.15 -37.4 81.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.625 -0.716 . . . . 1.42 111.496 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.11 -50.12 62.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.236 -0.438 . . . . 2.01 111.294 -175.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.71 -33.1 74.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.171 0.51 . . . . 1.48 109.925 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.4 87.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.531 0.682 . . . . 0.2 110.115 178.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -69.68 -43.02 73.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.248 -0.887 . . . . 0.63 109.759 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.43 -37.8 84.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.566 -0.743 . . . . 1.99 111.215 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.49 HD12 HD21 ' A' ' 209' ' ' LEU . 32.5 mt -72.71 -36.34 67.8 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.829 -0.348 . . . . 0.2 110.44 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 202' ' ' GLN . 64.4 ttt180 -57.25 -41.97 80.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.099 0.476 . . . . 1.29 110.358 175.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.4 t -70.45 -48.71 58.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.666 -0.697 . . . . 0.19 109.968 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.28 -48.71 80.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.995 -1.002 . . . . 0.26 110.845 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.69 83.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.684 -0.689 . . . . 1.25 110.538 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.552 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.8 tttt -67.66 -33.89 75.85 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.705 -0.398 . . . . 0.36 110.798 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 28.3 mm-40 -74.58 -30.64 61.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 2.28 109.69 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.27 -41.35 85.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 0.16 109.411 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.46 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.0 t90 -65.11 -39.36 92.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.066 -0.97 . . . . 0.19 109.963 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.2 mmm180 -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.086 -0.506 . . . . 2.25 111.09 176.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.08 -4.62 36.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.148 0.499 . . . . 1.16 110.972 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 24.3 t -80.22 -14.46 58.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.493 -0.558 . . . . 0.93 109.493 176.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.717 -0.659 . . . . 1.27 110.048 177.631 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 113.239 0.829 . . . . 1.24 113.239 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 14.9 p -87.18 -31.45 5.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.238 -0.585 . . . . 0.34 111.125 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.443 HG22 HD11 ' A' ' 209' ' ' LEU . 27.7 t -68.11 -21.37 26.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.498 0.666 . . . . 0.23 110.381 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.52 11.67 12.11 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.907 -0.588 . . . . 0.23 111.373 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 45.1 p -106.34 145.88 31.12 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.245 0.545 . . . . 0.25 110.019 -175.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.71 -32.3 73.78 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.136 -0.938 . . . . 2.46 109.678 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.93 84.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.349 -0.841 . . . . 0.27 111.578 176.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.73 -50.75 69.87 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.902 -0.407 . . . . 0.22 109.902 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.12 -29.4 67.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.634 -0.712 . . . . 0.16 111.662 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -66.14 -48.52 70.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.04 0.448 . . . . 1.25 110.336 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -72.51 -32.57 66.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.226 -0.443 . . . . 1.37 110.95 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . 0.401 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.9 tm? -58.51 -47.15 85.09 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.108 -0.701 . . . . 0.17 109.108 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.474 ' HB2' ' HD2' ' B' ' 219' ' ' ARG . 50.0 tt0 -65.93 -34.03 77.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.71 110.322 176.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.484 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -61.06 -40.37 98.42 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.827 -0.701 . . . . 0.16 112.051 176.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -66.0 -38.61 88.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.646 0.736 . . . . 1.26 109.2 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 2.9 mp -65.58 -33.57 76.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.936 -1.029 . . . . 0.2 110.719 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.93 -44.23 85.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.837 0.351 . . . . 1.14 110.411 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 50.2 mt-30 -59.48 -47.0 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.984 -0.553 . . . . 1.13 111.636 179.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.38 -47.11 16.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.289 0.478 . . . . 1.98 112.289 -175.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.487 HD21 HD12 ' B' ' 218' ' ' LEU . 8.7 mp -81.65 -21.94 37.85 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.845 0.313 . . . . 0.45 111.845 -172.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.28 35.6 20.78 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 124.098 0.874 . . . . 2.19 110.574 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -158.06 118.71 3.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 1.11 110.214 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -68.08 -37.54 81.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.665 -0.698 . . . . 1.41 111.525 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.94 -49.93 63.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.199 -0.455 . . . . 2.0 111.326 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -68.03 -33.13 74.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 1.48 109.965 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.39 87.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 0.21 110.095 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.482 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.63 -43.14 73.3 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.372 -0.831 . . . . 0.63 109.792 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.38 -37.89 85.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.462 -0.79 . . . . 1.97 111.103 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.487 HD12 HD21 ' B' ' 209' ' ' LEU . 32.4 mt -72.59 -36.53 68.17 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.772 -0.371 . . . . 0.2 110.348 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . 0.474 ' HD2' ' HB2' ' B' ' 202' ' ' GLN . 64.0 ttt180 -56.98 -42.08 79.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.064 0.459 . . . . 1.29 110.244 175.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 216' ' ' ASN . 80.1 t -70.48 -48.61 58.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.19 109.946 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.7 tp -59.46 -48.53 81.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.956 -1.02 . . . . 0.25 110.817 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.87 84.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.643 -0.708 . . . . 1.24 110.646 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.561 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.8 tttt -67.45 -34.12 76.55 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.799 -0.361 . . . . 0.35 110.79 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 28.4 mm-40 -74.61 -30.55 61.72 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.223 0.535 . . . . 2.27 109.728 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.19 -41.26 86.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.483 -0.781 . . . . 0.16 109.452 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.6 t90 -65.14 -39.33 92.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.02 -0.991 . . . . 0.19 109.984 177.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.561 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.3 mmm180 -64.6 -40.16 95.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 2.25 111.075 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.2 t -74.06 -4.94 38.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.046 0.45 . . . . 1.18 110.905 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.4 t -79.76 -14.85 58.42 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.65 -0.5 . . . . 0.93 109.65 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.625 -0.702 . . . . 1.27 110.094 177.655 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 CA--C 1.529 0.171 0 N-CA-C 112.497 0.554 . . . . 1.24 112.497 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.585 HG11 ' HA ' ' B' ' 209' ' ' LEU . 7.5 p -75.29 -30.35 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.35 110.812 -179.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 40.4 t -69.6 -20.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.565 0.698 . . . . 0.24 109.701 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.431 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.33 10.95 13.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.574 -0.739 . . . . 0.24 111.404 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 40.1 p -106.56 144.47 33.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.211 0.529 . . . . 0.26 110.005 -175.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.93 -31.23 72.03 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.278 -0.874 . . . . 2.46 109.429 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.65 89.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.106 -0.952 . . . . 0.26 111.247 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -61.71 -48.44 80.74 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.938 0.399 . . . . 0.22 109.971 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.78 -28.67 66.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.572 -0.74 . . . . 0.17 111.664 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -66.37 -48.99 68.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.834 0.349 . . . . 1.23 110.358 174.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.36 -37.91 86.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.05 0.452 . . . . 1.37 110.682 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.18 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.585 -0.734 . . . . 0.18 109.735 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.447 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 60.9 tt0 -64.2 -36.75 85.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.025 -0.534 . . . . 0.71 110.387 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.522 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.0 -41.79 98.07 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.034 -0.603 . . . . 0.16 112.069 177.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -66.56 -39.07 88.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.172 0.51 . . . . 1.26 109.637 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.5 mp -64.98 -34.15 77.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.565 -0.743 . . . . 0.19 110.539 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 47.3 mt-10 -65.97 -43.98 86.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.674 0.274 . . . . 1.13 110.488 176.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 46.3 mt-30 -62.85 -48.81 77.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.433 . . . . 1.13 111.691 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.8 tpt85 -77.87 -43.61 29.66 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.989 -0.551 . . . . 1.97 111.531 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.609 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 3.1 mp -84.25 -23.29 30.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.243 -0.435 . . . . 0.45 112.16 -176.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.37 36.27 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.84 0.713 . . . . 2.19 111.133 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -156.88 117.09 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.994 -0.548 . . . . 1.12 110.266 -177.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -67.79 -37.19 81.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.684 -0.689 . . . . 1.42 111.355 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -62.58 -50.18 72.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.318 -0.401 . . . . 2.01 110.917 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.49 -37.62 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.972 -0.558 . . . . 1.48 110.005 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.11 -41.65 90.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.82 -0.627 . . . . 0.2 110.618 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 220' ' ' VAL . 0.2 OUTLIER -70.87 -41.94 70.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.597 -0.728 . . . . 0.63 110.253 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -59.95 -43.07 95.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.013 -0.54 . . . . 1.99 110.684 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.426 HD12 HD21 ' A' ' 209' ' ' LEU . 63.1 mt -72.91 -34.86 66.88 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.744 -0.662 . . . . 0.2 110.196 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -57.42 -44.32 84.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.134 0.492 . . . . 1.29 110.036 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 216' ' ' ASN . 73.4 t -71.68 -49.23 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.674 -0.694 . . . . 0.19 110.28 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.69 -48.68 80.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.028 -0.987 . . . . 0.26 110.783 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -65.23 -38.85 91.69 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.649 -0.705 . . . . 1.25 110.585 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.3 tttt -65.75 -33.84 76.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.841 -0.343 . . . . 0.36 110.866 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -76.97 -29.33 55.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.944 0.402 . . . . 2.28 110.248 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.74 87.25 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.767 -0.652 . . . . 0.16 109.358 173.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.431 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.7 t90 -63.61 -37.1 86.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.061 -0.972 . . . . 0.19 109.965 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 37.1 mmt180 -62.34 -37.85 87.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.157 -0.474 . . . . 2.25 110.686 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 18.4 t -75.23 -10.05 59.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.308 -0.406 . . . . 1.16 110.962 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.2 t -76.61 -7.35 55.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.037 0.446 . . . . 0.93 109.89 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.708 -0.663 . . . . 1.27 109.894 175.867 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.462 0.139 0 N-CA-C 112.409 0.522 . . . . 1.24 112.409 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . 0.515 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.5 p -74.95 -30.68 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.794 0.331 . . . . 0.34 110.868 -178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.48 -20.79 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.681 0.753 . . . . 0.23 109.74 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.434 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.04 10.9 12.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.42 -0.809 . . . . 0.23 111.551 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 41.5 p -106.75 144.3 33.6 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.216 0.531 . . . . 0.25 109.968 -175.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -65.86 -31.33 72.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.253 -0.885 . . . . 2.46 109.373 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.72 89.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.121 -0.945 . . . . 0.27 111.356 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -61.63 -48.48 80.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.941 -0.392 . . . . 0.22 109.941 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.67 -28.59 67.01 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.666 -0.697 . . . . 0.16 111.707 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.44 -48.99 68.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.72 0.295 . . . . 1.25 110.385 174.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -66.31 -37.97 86.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.966 0.412 . . . . 1.37 110.737 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.2 -47.0 86.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 0.17 109.646 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 61.1 tt0 -63.85 -36.95 85.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.71 110.459 177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.513 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.18 -41.74 98.32 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.104 -0.569 . . . . 0.16 111.996 177.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -66.48 -39.11 88.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.62 -0.511 . . . . 1.26 109.62 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.4 mp -64.96 -34.1 77.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.623 -0.717 . . . . 0.2 110.434 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 45.2 mt-10 -66.22 -43.49 86.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.734 0.302 . . . . 1.14 110.499 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 46.7 mt-30 -63.22 -48.92 76.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.019 0.437 . . . . 1.13 111.808 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 3.9 tpt85 -77.81 -43.47 30.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.959 -0.564 . . . . 1.98 111.456 -173.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 2.9 mp -84.17 -23.51 30.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.227 -0.442 . . . . 0.45 112.187 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.54 35.97 26.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.582 -0.735 . . . . 2.19 111.131 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -156.5 117.41 3.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.005 -0.543 . . . . 1.11 110.238 -177.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -67.85 -37.42 81.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.766 -0.652 . . . . 1.41 111.367 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.45 -50.31 71.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 2.0 110.817 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.44 -37.37 87.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.084 -0.507 . . . . 1.48 109.957 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.32 -41.59 89.43 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.887 -0.597 . . . . 0.21 110.644 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' B' ' 220' ' ' VAL . 0.2 OUTLIER -70.77 -42.28 70.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.665 -0.698 . . . . 0.63 110.184 -179.402 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -59.71 -43.07 94.27 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.97 110.67 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.411 HD12 HD21 ' B' ' 209' ' ' LEU . 63.3 mt -72.94 -34.75 66.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.85 -0.614 . . . . 0.2 110.241 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -57.66 -44.28 85.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.06 0.457 . . . . 1.29 110.06 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 216' ' ' ASN . 66.7 t -71.54 -49.45 46.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.749 -0.659 . . . . 0.19 110.277 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.9 tp -58.3 -48.7 79.67 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.002 -0.999 . . . . 0.25 110.981 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -65.13 -38.93 92.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.668 -0.696 . . . . 1.24 110.577 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.2 tttt -65.56 -34.08 77.42 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.929 -0.309 . . . . 0.35 110.926 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -76.92 -29.33 55.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.09 0.471 . . . . 2.27 110.096 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.47 -42.65 87.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.29 -0.633 . . . . 0.16 109.29 173.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.434 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 52.6 t90 -63.62 -37.08 85.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.995 -1.002 . . . . 0.19 110.017 176.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 37.0 mmt180 -62.37 -37.63 86.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 2.25 110.859 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.9 t -75.58 -9.95 59.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 1.18 110.788 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 19.4 t -76.46 -7.84 55.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.172 0.51 . . . . 0.93 110.054 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.652 -0.689 . . . . 1.27 109.849 175.893 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.458 -0.071 0 N-CA-C 112.102 0.408 . . . . 1.24 112.102 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.448 HG21 ' HG3' ' B' ' 208' ' ' ARG . 11.9 p -70.06 -32.85 52.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.773 -0.371 . . . . 0.35 110.939 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 22.1 t -66.97 -19.85 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.69 0.757 . . . . 0.24 109.749 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.458 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -90.04 12.2 18.41 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.613 -0.721 . . . . 0.24 111.597 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 42.8 p -107.86 152.18 24.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.227 0.536 . . . . 0.26 110.362 -176.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.51 -32.69 74.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.385 -0.825 . . . . 2.46 109.708 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.61 90.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.23 -0.896 . . . . 0.26 111.863 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -62.35 -50.94 69.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.22 110.236 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -69.18 -28.27 66.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.705 -0.679 . . . . 0.17 111.448 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.66 -51.98 65.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 1.23 110.509 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.65 -32.5 65.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.275 -0.42 . . . . 1.37 111.371 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.86 -47.78 83.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.166 -0.679 . . . . 0.18 109.166 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.2 tt0 -67.0 -33.18 75.0 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.925 -0.58 . . . . 0.71 110.195 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.77 -40.12 97.7 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.928 -0.653 . . . . 0.16 111.906 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -67.16 -38.73 85.98 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.528 -0.545 . . . . 1.26 109.528 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.7 mp -66.19 -38.19 87.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.529 -0.76 . . . . 0.19 110.561 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.7 mt-10 -63.36 -48.54 77.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.362 . . . . 1.13 110.863 176.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 95.9 mt-30 -66.24 -40.94 90.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.357 -0.383 . . . . 1.13 112.011 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.467 ' HG3' HG21 ' B' ' 191' ' ' VAL . 5.0 tpt180 -77.75 -48.47 16.57 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.814 0.301 . . . . 1.97 111.814 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.1 mp -82.31 -23.34 35.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 0.45 111.784 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 207' ' ' GLN . 33.9 mmtp 58.76 39.82 23.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.274 -0.875 . . . . 2.19 110.487 -174.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -153.1 109.4 3.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.572 -0.74 . . . . 1.12 109.812 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -67.61 -36.43 80.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.279 -0.419 . . . . 1.42 111.497 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -64.05 -50.4 68.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.871 0.367 . . . . 2.01 110.712 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.67 -29.86 66.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.095 -0.502 . . . . 1.48 110.29 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.35 85.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.547 0.689 . . . . 0.2 109.752 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.2 t-20 -70.1 -46.25 65.25 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.066 -0.97 . . . . 0.63 110.318 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -59.07 -40.72 86.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 1.99 110.899 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.63 -36.89 68.14 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.003 -0.544 . . . . 0.2 110.38 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -58.94 -42.55 90.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.926 0.393 . . . . 1.29 110.388 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.9 t -71.13 -44.63 74.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.924 -0.58 . . . . 0.19 109.707 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.0 tp -57.24 -50.86 71.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.891 -1.049 . . . . 0.26 110.89 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.75 -37.14 81.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.212 -0.904 . . . . 1.25 110.591 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.7 tttt -66.09 -36.38 83.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.36 110.68 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.192 0.52 . . . . 2.28 110.042 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.17 -40.57 86.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.493 -0.776 . . . . 0.16 109.346 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.458 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 47.5 t90 -67.35 -39.81 85.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.063 -0.971 . . . . 0.19 110.366 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.609 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.6 mmm180 -61.32 -39.06 89.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.966 0.412 . . . . 2.25 110.467 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.06 -6.21 46.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 1.16 111.131 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 65.8 m -84.52 -9.59 58.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.989 0.423 . . . . 0.93 110.667 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.289 -0.862 . . . . 1.27 110.184 176.074 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.23 0.056 0 N-CA-C 111.959 0.355 . . . . 1.24 111.959 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . 0.467 HG21 ' HG3' ' A' ' 208' ' ' ARG . 12.1 p -70.18 -32.95 52.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 C-N-CA 120.961 -0.296 . . . . 0.34 110.883 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 22.4 t -66.95 -19.88 26.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.619 0.723 . . . . 0.23 109.747 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.464 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -90.1 12.37 17.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.613 -0.721 . . . . 0.23 111.432 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.99 152.12 24.9 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.376 0.607 . . . . 0.25 110.355 -176.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.4 -32.65 74.16 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.295 -0.866 . . . . 2.46 109.826 176.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.75 90.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.331 -0.85 . . . . 0.27 111.856 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -62.16 -51.08 69.28 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.22 110.196 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -69.1 -28.13 66.21 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.621 -0.718 . . . . 0.16 111.536 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.64 -51.96 65.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.851 0.358 . . . . 1.25 110.487 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.68 -32.52 65.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 1.37 111.386 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.13 -47.58 84.76 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.194 -0.669 . . . . 0.17 109.194 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.0 tt0 -66.99 -33.31 75.3 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.71 110.252 176.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.75 -40.13 97.69 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 121.076 -0.583 . . . . 0.16 112.007 176.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -67.01 -38.73 86.47 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.566 -0.531 . . . . 1.26 109.566 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.6 mp -66.08 -38.38 88.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.433 -0.803 . . . . 0.2 110.528 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.8 mt-10 -63.24 -48.81 76.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.841 0.353 . . . . 1.14 110.801 176.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 95.8 mt-30 -66.09 -40.93 91.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.196 -0.456 . . . . 1.13 111.971 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . 0.448 ' HG3' HG21 ' A' ' 191' ' ' VAL . 5.0 tpt180 -77.8 -48.53 16.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.753 0.311 . . . . 1.98 111.731 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.1 mp -82.38 -23.12 35.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.815 0.302 . . . . 0.45 111.815 -175.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' B' ' 207' ' ' GLN . 33.9 mmtp 58.47 39.8 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.393 -0.822 . . . . 2.19 110.484 -174.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.05 109.72 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.507 -0.769 . . . . 1.11 109.736 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -67.55 -36.28 80.66 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.275 -0.421 . . . . 1.41 111.49 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.33 -50.19 68.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.86 0.362 . . . . 2.0 110.804 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.78 -29.88 66.2 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.126 -0.488 . . . . 1.48 110.113 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.23 85.63 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.516 0.674 . . . . 0.21 109.641 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.415 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.3 t-20 -70.22 -46.63 64.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.14 -0.936 . . . . 0.63 110.27 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -58.65 -40.79 84.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 1.97 110.912 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.71 -36.61 67.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.002 -0.544 . . . . 0.2 110.364 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -59.04 -42.63 90.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.898 0.38 . . . . 1.29 110.367 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 216' ' ' ASN . 84.6 t -71.23 -44.6 73.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.42 0.628 . . . . 0.19 109.678 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.12 -50.73 71.89 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.945 -1.025 . . . . 0.25 110.915 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.99 -37.34 81.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 1.24 110.609 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.608 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.7 tttt -65.87 -36.38 83.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.505 -0.316 . . . . 0.35 110.716 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.21 -31.64 64.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.133 0.492 . . . . 2.27 109.921 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.62 86.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.16 109.341 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.464 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 47.1 t90 -67.49 -39.57 85.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.029 -0.987 . . . . 0.19 110.283 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.2 mmm180 -61.29 -39.34 90.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 2.25 110.423 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.31 -5.56 42.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 1.18 111.167 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 59.6 m -84.84 -9.81 57.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.045 0.45 . . . . 0.93 110.64 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.579 -0.724 . . . . 1.27 110.189 175.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 111.895 0.331 . . . . 1.24 111.895 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 9.5 p -79.56 -25.8 12.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 C-N-CA 120.231 -0.587 . . . . 0.35 110.034 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.433 HG22 HD11 ' B' ' 209' ' ' LEU . 51.2 t -69.05 -25.0 28.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.411 0.625 . . . . 0.24 109.815 176.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -82.64 12.05 5.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.726 -0.67 . . . . 0.24 111.842 -177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.03 153.01 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.918 0.389 . . . . 0.26 110.487 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.97 -34.77 78.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.866 -0.606 . . . . 2.46 109.747 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.26 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.453 -0.794 . . . . 0.26 111.829 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . 0.479 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 59.3 t80 -61.9 -51.13 69.41 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.824 0.345 . . . . 0.22 110.099 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . 0.429 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 97.2 m95 -69.02 -28.38 66.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.496 -0.775 . . . . 0.17 111.54 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.17 -49.77 70.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.279 -0.418 . . . . 1.23 110.408 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.01 -33.7 70.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 1.37 110.904 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.405 ' O ' HD13 ' A' ' 205' ' ' LEU . 1.7 tm? -59.49 -47.63 84.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.378 -0.601 . . . . 0.18 109.378 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.5 tt0 -66.47 -33.47 75.76 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.089 -0.505 . . . . 0.71 110.272 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.8 -41.28 99.08 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 121.049 -0.596 . . . . 0.16 111.929 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -66.95 -38.4 86.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 1.26 109.784 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.8 mp -65.22 -37.76 88.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.582 -0.735 . . . . 0.19 110.475 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 49.7 mt-10 -65.9 -45.41 82.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.567 -0.288 . . . . 1.13 110.828 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.0 mt-30 -61.97 -48.29 81.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.931 0.396 . . . . 1.13 111.459 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -72.75 -48.31 39.57 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.941 -0.572 . . . . 1.97 111.383 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.455 HD11 HG22 ' B' ' 192' ' ' VAL . 6.6 mp -83.13 -23.12 33.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.079 -0.509 . . . . 0.45 111.352 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.56 39.97 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.222 -0.899 . . . . 2.19 109.928 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.85 113.75 3.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.624 -0.716 . . . . 1.12 110.434 -176.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -67.87 -33.85 75.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.853 -0.612 . . . . 1.42 111.244 -177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.67 -51.11 61.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.449 . . . . 2.01 111.026 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -68.82 -35.09 76.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 1.48 109.988 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.82 -39.34 87.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.738 -0.664 . . . . 0.2 110.486 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.1 t-20 -66.98 -48.31 68.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.57 -0.741 . . . . 0.63 110.311 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.99 -39.22 77.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.88 -0.6 . . . . 1.99 111.027 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 42.7 mt -72.66 -39.43 67.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.138 -0.483 . . . . 0.2 110.9 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.26 -41.02 87.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.059 0.457 . . . . 1.29 110.179 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.464 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 87.3 t -70.24 -44.69 77.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.689 -0.687 . . . . 0.19 109.66 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.0 -49.89 76.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.98 -1.009 . . . . 0.26 110.624 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -68.1 -38.56 82.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.329 -0.85 . . . . 1.25 110.852 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.8 tttt -67.11 -36.16 81.34 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.823 -0.351 . . . . 0.36 110.821 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 47.3 mm-40 -75.38 -28.9 59.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.04 0.447 . . . . 2.28 110.024 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.2 -40.04 82.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.65 -0.705 . . . . 0.16 109.301 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 51.5 t90 -64.7 -40.21 94.98 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.917 -1.038 . . . . 0.19 109.851 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.8 mmm180 -62.97 -39.99 96.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.997 -0.547 . . . . 2.25 110.661 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 25.9 t -73.48 -6.1 44.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 1.16 111.116 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.0 t -79.28 -13.56 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.154 0.502 . . . . 0.93 109.756 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.576 -0.726 . . . . 1.27 110.01 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 111.931 0.345 . . . . 1.24 111.931 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . 0.483 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 9.4 p -79.58 -25.71 12.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 120.262 -0.575 . . . . 0.34 109.96 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.455 HG22 HD11 ' A' ' 209' ' ' LEU . 51.5 t -69.09 -25.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.423 0.63 . . . . 0.23 109.8 176.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -82.38 11.82 5.12 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.763 -0.653 . . . . 0.23 111.949 -177.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.01 153.07 23.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.967 0.413 . . . . 0.25 110.49 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.0 -34.59 78.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.756 -0.656 . . . . 2.46 109.823 176.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.79 84.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.343 -0.844 . . . . 0.27 111.828 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -61.81 -51.14 69.49 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.22 110.134 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . 0.437 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 97.2 m95 -69.17 -28.31 66.29 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.511 -0.768 . . . . 0.16 111.453 -178.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.11 -49.8 70.79 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.232 -0.44 . . . . 1.25 110.473 174.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.12 -33.75 70.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 1.37 110.864 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . 0.41 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.8 tm? -59.23 -47.88 83.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.326 -0.62 . . . . 0.17 109.326 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.423 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.4 tt0 -66.25 -33.63 76.18 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.969 -0.56 . . . . 0.71 110.349 176.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.67 -41.07 98.79 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.057 -0.592 . . . . 0.16 111.873 176.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -67.32 -38.37 84.82 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.668 -0.493 . . . . 1.26 109.668 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.9 mp -65.13 -37.69 88.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.755 . . . . 0.2 110.55 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 49.3 mt-10 -65.77 -45.82 81.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.589 -0.278 . . . . 1.14 110.873 177.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 52.9 mt-30 -61.74 -48.27 81.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 1.13 111.375 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' B' ' 208' ' ' ARG . 4.4 tpt180 -72.66 -48.18 41.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.81 -0.632 . . . . 1.98 111.482 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.6 mp -83.43 -23.02 32.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.05 -0.523 . . . . 0.45 111.496 -176.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' B' ' 210' ' ' LYS . 45.4 tptt 55.67 39.62 30.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.254 -0.885 . . . . 2.19 109.928 -175.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.79 113.52 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.594 -0.73 . . . . 1.11 110.32 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -67.84 -33.71 75.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.792 -0.64 . . . . 1.41 111.22 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.8 -51.09 61.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.233 -0.44 . . . . 2.0 110.91 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.95 -35.09 76.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.858 -0.61 . . . . 1.48 109.957 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.31 87.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.759 -0.655 . . . . 0.21 110.45 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.446 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.3 t-20 -66.93 -48.46 68.55 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.56 -0.745 . . . . 0.63 110.382 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.97 -39.04 77.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.917 -0.583 . . . . 1.97 111.011 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.413 HD11 HG21 ' A' ' 192' ' ' VAL . 42.6 mt -72.82 -39.46 66.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.207 -0.451 . . . . 0.2 110.916 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.17 -41.15 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 1.29 110.236 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 90.1 t -70.24 -44.66 77.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.684 -0.689 . . . . 0.19 109.647 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 61.0 tp -59.06 -49.61 77.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.869 -1.059 . . . . 0.25 110.683 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -68.33 -38.35 81.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.428 -0.805 . . . . 1.24 110.869 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.9 tttt -67.2 -36.23 81.3 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.837 -0.345 . . . . 0.35 110.89 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 49.7 mm-40 -75.34 -28.74 59.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 2.27 110.056 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.94 81.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.639 -0.71 . . . . 0.16 109.313 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.3 t90 -64.8 -40.05 94.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.846 -1.07 . . . . 0.19 109.854 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.7 mmm180 -63.12 -40.08 96.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.867 -0.606 . . . . 2.25 110.693 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.6 t -73.38 -5.84 42.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.858 0.361 . . . . 1.18 111.108 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 20.9 t -79.35 -13.71 59.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.157 0.503 . . . . 0.93 109.847 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.245 0.832 0 CA-C-O 118.58 -0.724 . . . . 1.27 110.142 177.513 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.946 0.403 . . . . 1.24 110.818 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 14.4 p -76.36 -30.36 19.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 116.236 -0.438 . . . . 0.35 110.185 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.442 HG22 HD11 ' B' ' 209' ' ' LEU . 60.7 t -69.7 -23.68 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.545 0.688 . . . . 0.24 109.614 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.24 12.43 5.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.477 -0.783 . . . . 0.24 111.505 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.82 150.23 27.27 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.076 0.465 . . . . 0.26 110.494 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.41 -34.14 77.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.417 -0.811 . . . . 2.46 109.844 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.0 -35.33 78.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.165 -0.925 . . . . 0.26 111.809 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 58.9 t80 -63.87 -51.04 66.4 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.865 0.364 . . . . 0.22 110.123 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 93.9 m95 -68.11 -29.89 68.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 0.17 111.255 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.9 -43.92 78.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.432 -0.349 . . . . 1.23 110.338 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -71.7 -35.85 70.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.212 0.53 . . . . 1.37 109.75 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.65 -47.73 83.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.426 -0.806 . . . . 0.18 109.348 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.507 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.62 -28.68 67.95 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.196 -0.457 . . . . 0.71 110.204 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.27 -41.77 98.46 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.854 -0.689 . . . . 0.16 111.599 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -66.81 -38.24 86.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 1.26 109.87 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.1 mp -66.5 -40.03 89.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.754 -0.657 . . . . 0.19 110.698 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.13 -43.61 91.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.568 0.223 . . . . 1.13 110.939 177.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.429 ' O ' ' HE2' ' A' ' 210' ' ' LYS . 49.4 mt-30 -60.8 -48.94 79.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.823 0.344 . . . . 1.13 111.707 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.24 -43.49 51.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.153 -0.476 . . . . 1.97 111.55 -173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.459 HD11 HG22 ' B' ' 192' ' ' VAL . 7.9 mp -88.28 -23.71 23.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.218 -0.446 . . . . 0.45 112.202 -174.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . 0.429 ' HE2' ' O ' ' A' ' 207' ' ' GLN . 75.5 mmtt 55.09 38.61 30.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.868 -0.605 . . . . 2.19 110.679 -175.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -150.03 110.68 4.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 1.12 109.351 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -65.29 -38.98 91.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.133 -0.485 . . . . 1.42 111.46 -175.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.37 -50.42 69.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.264 -0.425 . . . . 2.01 111.02 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -69.23 -35.1 75.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.002 0.43 . . . . 1.48 110.461 -177.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.47 89.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.359 0.6 . . . . 0.2 110.203 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 2.7 t-20 -70.19 -45.38 66.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.164 -0.925 . . . . 0.63 109.904 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -58.0 -40.44 80.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.645 -0.707 . . . . 1.99 111.134 177.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.401 ' HB2' HD23 ' A' ' 205' ' ' LEU . 56.7 mt -72.47 -37.51 68.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.16 -0.473 . . . . 0.2 110.455 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . 0.507 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 48.4 ttp180 -56.36 -41.44 76.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.103 0.478 . . . . 1.29 110.155 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.612 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 89.2 t -70.57 -49.1 54.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.509 -0.768 . . . . 0.19 109.901 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.76 -48.74 78.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.867 -1.061 . . . . 0.26 110.829 -177.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -66.27 -38.32 87.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.61 -0.723 . . . . 1.25 110.524 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.2 tttt -64.4 -36.9 85.67 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.36 110.81 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 51.9 mt-10 -73.96 -30.59 62.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 2.28 109.735 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.5 -43.51 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.658 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -64.69 -39.96 94.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.19 110.08 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.8 mmm180 -63.21 -39.23 94.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 2.25 111.088 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 22.0 m -73.98 -5.01 38.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.499 -0.319 . . . . 1.16 111.446 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 27.4 t -79.66 -11.53 59.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.281 0.562 . . . . 0.93 109.749 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.435 -0.793 . . . . 1.27 110.205 178.231 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.911 0.386 . . . . 1.24 110.746 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 14.5 p -76.12 -30.16 20.15 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.372 -0.376 . . . . 0.34 110.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.459 HG22 HD11 ' A' ' 209' ' ' LEU . 60.5 t -69.82 -23.45 25.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.541 0.686 . . . . 0.23 109.585 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.51 12.25 5.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.543 -0.753 . . . . 0.23 111.516 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 42.1 p -107.58 150.18 27.16 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.191 0.519 . . . . 0.25 110.446 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.41 -34.21 77.76 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.358 -0.837 . . . . 2.46 109.777 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.29 78.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.267 -0.878 . . . . 0.27 111.798 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -63.79 -50.86 67.33 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 120.914 0.388 . . . . 0.22 110.207 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . 0.471 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 94.0 m95 -68.39 -29.86 68.65 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.756 -0.657 . . . . 0.16 111.238 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -67.81 -43.6 79.26 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.836 0.35 . . . . 1.25 110.557 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.0 -35.76 69.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.326 0.584 . . . . 1.37 109.84 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.7 -47.71 83.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.17 109.31 175.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.61 -28.81 68.06 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 116.157 -0.474 . . . . 0.71 110.24 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.21 -41.63 98.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.793 -0.718 . . . . 0.16 111.623 174.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -66.9 -38.07 85.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.004 0.43 . . . . 1.26 109.856 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.2 mp -66.77 -40.01 88.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.724 -0.671 . . . . 0.2 110.623 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.96 -43.73 91.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.805 -0.18 . . . . 1.14 110.896 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.431 ' O ' ' HE2' ' B' ' 210' ' ' LYS . 49.2 mt-30 -61.25 -48.08 83.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 1.13 111.882 177.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.62 -43.64 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.21 -0.45 . . . . 1.98 111.476 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.442 HD11 HG22 ' A' ' 192' ' ' VAL . 8.1 mp -88.2 -23.88 23.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.065 -0.516 . . . . 0.45 112.085 -174.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' B' ' 207' ' ' GLN . 75.4 mmtt 55.4 38.31 30.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.753 -0.658 . . . . 2.19 110.689 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -149.64 110.76 4.38 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.701 -0.682 . . . . 1.11 109.476 -176.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -64.98 -39.13 93.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 1.41 111.611 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -63.33 -50.5 69.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.388 -0.369 . . . . 2.0 111.089 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -69.3 -35.1 75.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 1.48 110.362 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.04 -39.56 90.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.21 110.209 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' B' ' 220' ' ' VAL . 2.7 t-20 -70.26 -45.37 66.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.181 -0.918 . . . . 0.63 109.929 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -58.0 -40.48 80.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.97 111.059 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.404 ' HB2' HD23 ' B' ' 205' ' ' LEU . 57.9 mt -72.4 -37.54 68.65 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.165 -0.47 . . . . 0.2 110.519 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 48.3 ttp180 -56.43 -41.33 76.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 1.29 110.221 175.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 93.5 t -70.57 -49.11 54.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.548 -0.751 . . . . 0.19 109.866 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.07 -48.6 79.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.849 -1.069 . . . . 0.25 110.793 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -66.23 -38.22 87.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.632 -0.713 . . . . 1.24 110.552 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.1 tttt -64.59 -36.73 85.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.835 -0.346 . . . . 0.35 110.783 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 54.1 mt-10 -74.13 -30.57 62.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.611 -0.514 . . . . 2.27 109.611 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.46 -43.72 84.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.621 -0.718 . . . . 0.16 109.67 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . . . . . . . . . 57.2 t90 -64.64 -39.76 94.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.323 -0.853 . . . . 0.19 110.096 177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.9 mmm180 -63.58 -39.13 93.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 2.25 110.985 177.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.2 m -74.07 -4.57 36.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.556 -0.293 . . . . 1.18 111.353 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 25.1 t -79.89 -11.78 59.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.93 109.78 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.49 -0.767 . . . . 1.27 110.134 178.185 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.532 0.252 0 N-CA-C 112.618 0.599 . . . . 1.24 112.618 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -79.65 -28.03 12.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.321 -0.552 . . . . 0.35 110.491 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.468 HG22 HD11 ' B' ' 209' ' ' LEU . 40.7 t -68.5 -23.26 27.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.506 0.67 . . . . 0.24 109.912 177.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.61 12.28 6.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.725 -0.671 . . . . 0.24 111.658 -178.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 48.4 p -106.9 145.67 31.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.246 0.546 . . . . 0.26 110.108 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.13 -32.15 73.7 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.38 -0.827 . . . . 2.46 109.776 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.63 -36.47 82.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.736 -0.665 . . . . 0.26 111.564 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -61.8 -50.9 70.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.016 0.436 . . . . 0.22 109.959 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -69.07 -28.58 66.66 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.17 111.463 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.56 -49.39 71.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 1.23 110.281 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -72.68 -33.58 66.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.247 -0.433 . . . . 1.37 111.137 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.96 -47.53 84.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.229 -0.656 . . . . 0.18 109.229 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 55.7 tt0 -65.94 -35.54 80.89 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.954 -0.566 . . . . 0.71 110.302 175.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -58.74 -41.96 96.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.033 -0.603 . . . . 0.16 112.017 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -67.44 -38.12 84.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.456 -0.572 . . . . 1.26 109.456 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.5 mp -65.91 -35.44 80.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.394 -0.821 . . . . 0.19 110.68 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.9 mt-10 -64.53 -48.89 73.42 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.94 0.4 . . . . 1.13 110.48 177.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 48.4 mt-30 -65.44 -41.83 93.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.908 -0.587 . . . . 1.13 111.622 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.64 -50.78 16.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.176 -0.465 . . . . 1.97 111.447 -177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.0 mp -78.16 -22.11 49.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.45 112.071 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.57 16.12 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.899 0.749 . . . . 2.19 110.464 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.4 118.97 3.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.237 -0.438 . . . . 1.12 110.384 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -68.7 -37.78 79.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.771 -0.649 . . . . 1.42 111.609 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.82 -49.66 71.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.401 -0.363 . . . . 2.01 111.096 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.62 -31.09 70.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.198 0.523 . . . . 1.48 110.04 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.26 84.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 0.2 110.029 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.8 t-20 -69.2 -44.51 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.516 -0.765 . . . . 0.63 109.978 177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.18 -41.51 84.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.851 -0.613 . . . . 1.99 110.887 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.471 HD11 HG21 ' B' ' 192' ' ' VAL . 40.8 mt -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.105 -0.498 . . . . 0.2 110.731 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -59.96 -43.67 94.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.023 0.44 . . . . 1.29 110.184 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.616 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 64.5 t -70.48 -46.7 69.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.694 -0.685 . . . . 0.19 109.546 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.19 -49.07 78.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.02 -0.991 . . . . 0.26 110.728 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -67.72 -36.82 81.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.508 -0.769 . . . . 1.25 110.579 -178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.508 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.3 tttt -68.42 -33.86 74.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.638 0.256 . . . . 0.36 110.96 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 51.1 mm-40 -75.4 -29.25 59.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.326 0.584 . . . . 2.28 109.723 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' B' ' 225' ' ' ALA . . . -67.98 -40.31 83.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.384 -0.825 . . . . 0.16 109.2 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -65.52 -38.59 90.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.957 -1.02 . . . . 0.19 109.892 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 40.4 mmt180 -58.98 -41.13 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 2.25 110.383 173.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 17.6 m -73.85 -10.0 59.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 1.16 111.49 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 15.9 t -74.59 -13.77 60.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.871 0.367 . . . . 0.93 110.613 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.655 -0.688 . . . . 1.27 110.154 178.593 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 112.502 0.556 . . . . 1.24 112.502 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 10.5 p -80.1 -27.82 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.388 -0.525 . . . . 0.34 110.536 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 218' ' ' LEU . 40.5 t -68.48 -23.39 28.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.502 0.668 . . . . 0.23 110.003 177.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 11.96 6.32 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.596 -0.729 . . . . 0.23 111.555 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 47.5 p -106.34 145.79 31.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.168 0.508 . . . . 0.25 110.199 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.2 -32.15 73.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.457 -0.792 . . . . 2.46 109.751 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.23 82.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.682 -0.69 . . . . 0.27 111.625 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.91 -50.94 70.15 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.848 -0.427 . . . . 0.22 109.848 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -68.95 -28.79 66.96 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.39 -0.823 . . . . 0.16 111.557 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.48 -49.53 71.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.321 -0.4 . . . . 1.25 110.229 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.48 -33.63 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 1.37 111.189 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.95 -47.54 84.71 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.228 -0.656 . . . . 0.17 109.228 175.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.471 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 55.8 tt0 -65.91 -35.24 80.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.018 -0.537 . . . . 0.71 110.324 175.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.02 -42.01 96.73 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.046 -0.597 . . . . 0.16 112.168 177.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -67.35 -38.1 84.29 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.574 -0.528 . . . . 1.26 109.574 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.5 mp -65.94 -35.48 80.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.493 -0.776 . . . . 0.2 110.624 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.6 mt-10 -64.66 -48.68 73.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.794 0.33 . . . . 1.14 110.423 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 48.7 mt-30 -65.72 -41.65 92.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 1.13 111.564 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.59 -50.8 16.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.505 . . . . 1.98 111.431 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.0 mp -78.27 -22.19 48.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.45 112.089 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.64 16.09 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.907 0.755 . . . . 2.19 110.549 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.33 119.02 3.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 1.11 110.393 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -68.65 -37.64 79.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.831 -0.622 . . . . 1.41 111.557 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.0 -49.63 71.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.839 0.352 . . . . 2.0 111.035 -175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -68.83 -30.82 69.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.957 -0.565 . . . . 1.48 110.045 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.15 84.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.765 -0.652 . . . . 0.21 110.092 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.457 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.9 t-20 -69.17 -44.59 71.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.499 -0.773 . . . . 0.63 109.985 177.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.15 -41.31 83.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 1.97 111.001 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.465 HD12 HD21 ' B' ' 209' ' ' LEU . 40.1 mt -73.21 -36.62 66.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.063 -0.517 . . . . 0.2 110.682 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -60.0 -43.4 95.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.992 0.425 . . . . 1.29 110.218 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.6 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 62.0 t -70.6 -46.95 67.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 0.19 109.539 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.0 -48.87 78.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.924 -1.035 . . . . 0.25 110.855 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -67.82 -37.07 81.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.467 -0.788 . . . . 1.24 110.554 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.5 tttt -68.19 -34.24 75.93 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.068 -0.253 . . . . 0.35 110.936 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 52.3 mm-40 -75.25 -29.27 60.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.467 0.651 . . . . 2.27 109.675 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 225' ' ' ALA . . . -67.94 -40.34 83.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.232 174.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.5 t90 -65.39 -38.58 90.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.019 -0.992 . . . . 0.19 109.933 177.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 40.5 mmt180 -58.99 -41.06 86.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 2.25 110.372 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.5 m -73.73 -10.12 59.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.077 -0.51 . . . . 1.18 111.501 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 16.8 t -74.75 -13.65 60.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.975 0.417 . . . . 0.93 110.512 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.687 -0.673 . . . . 1.27 110.358 178.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--O 1.228 -0.03 0 CA-C-O 120.774 0.321 . . . . 1.24 111.096 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 CA-C-N 116.359 -0.382 . . . . 0.35 110.856 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.408 HG13 ' CE2' ' A' ' 197' ' ' PHE . 19.4 t -69.22 -20.16 24.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.457 0.646 . . . . 0.24 110.018 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.411 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -89.0 11.63 17.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.898 -0.592 . . . . 0.24 111.458 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 49.1 p -106.51 158.56 16.83 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.601 -0.44 . . . . 0.26 110.764 -175.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.04 -39.14 89.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.863 -0.608 . . . . 2.46 109.615 175.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.97 -38.45 76.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.131 -0.94 . . . . 0.26 112.292 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . 0.408 ' CE2' HG13 ' A' ' 192' ' ' VAL . 76.4 t80 -63.25 -51.31 66.71 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.749 -0.381 . . . . 0.22 110.348 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . 0.401 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 95.4 m95 -70.09 -29.13 66.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.803 -0.635 . . . . 0.17 111.505 -178.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -64.14 -52.02 61.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.135 -0.484 . . . . 1.23 110.413 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -71.61 -32.39 67.96 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 1.37 111.09 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.72 -46.75 86.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.171 -0.677 . . . . 0.18 109.171 175.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.27 -37.31 86.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.71 110.601 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.7 -39.52 95.35 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.938 -0.649 . . . . 0.16 112.142 176.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -66.14 -40.25 90.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.473 0.654 . . . . 1.26 109.294 177.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.9 mp -64.53 -34.28 77.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.07 -0.968 . . . . 0.19 110.487 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.66 -45.93 84.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.738 0.304 . . . . 1.13 110.419 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.6 mt-30 -58.93 -47.54 84.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 1.13 111.831 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.63 -45.41 17.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.236 -0.438 . . . . 1.97 112.136 -174.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.8 mp -82.16 -23.01 35.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.45 112.004 -172.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 56.81 37.24 28.67 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 123.969 0.793 . . . . 2.19 110.427 -176.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -156.47 110.3 2.71 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.566 -0.743 . . . . 1.12 109.8 -177.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.78 -34.16 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 1.42 111.222 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.27 -50.83 64.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.417 -0.356 . . . . 2.01 111.25 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.75 -27.95 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.422 . . . . 1.48 110.02 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.49 -37.21 84.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.493 0.663 . . . . 0.2 109.526 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 2.8 t-20 -70.21 -46.63 64.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.274 -0.876 . . . . 0.63 110.121 178.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -58.27 -39.7 79.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.729 -0.669 . . . . 1.99 111.077 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.544 HD12 HD21 ' A' ' 209' ' ' LEU . 33.5 mt -73.67 -36.29 65.31 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.183 -0.462 . . . . 0.2 110.653 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -57.66 -43.62 85.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.171 0.51 . . . . 1.29 110.007 177.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 58.8 t -71.38 -49.29 48.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.401 -0.818 . . . . 0.19 109.764 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.501 HD21 ' O ' ' B' ' 225' ' ' ALA . 56.6 tp -57.14 -48.2 79.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.867 -1.06 . . . . 0.26 110.994 -177.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.39 -37.42 86.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.598 -0.728 . . . . 1.25 110.409 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.9 tttt -66.25 -33.64 76.21 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.836 -0.346 . . . . 0.36 110.726 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.71 64.7 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.521 -0.548 . . . . 2.28 109.521 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . 0.467 ' O ' HD21 ' B' ' 221' ' ' LEU . . . -68.29 -42.17 79.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.374 -0.83 . . . . 0.16 109.672 176.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.411 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -63.69 -39.03 93.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.276 -0.875 . . . . 0.19 110.131 177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.6 mmm180 -64.12 -34.4 77.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.312 -0.403 . . . . 2.25 110.351 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -77.37 -7.35 55.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.526 -0.306 . . . . 1.16 111.032 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 32.4 t -75.21 -17.16 60.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.53 0.681 . . . . 0.93 109.563 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.413 -0.803 . . . . 1.27 109.684 176.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.581 0.229 . . . . 1.24 111.146 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.64 -36.37 77.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.368 -0.378 . . . . 0.34 110.816 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.414 HG22 HD11 ' A' ' 209' ' ' LEU . 19.2 t -68.98 -20.37 24.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.529 0.68 . . . . 0.23 110.002 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.42 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -89.05 11.54 18.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.876 -0.602 . . . . 0.23 111.52 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 50.1 p -106.52 158.65 16.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.93 0.395 . . . . 0.25 110.577 -175.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -65.97 -39.27 90.24 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.497 -0.557 . . . . 2.46 109.497 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.86 -38.65 76.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.157 -0.928 . . . . 0.27 112.36 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . 0.402 ' CE2' HG13 ' B' ' 192' ' ' VAL . 75.7 t80 -63.33 -51.2 66.97 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.714 -0.394 . . . . 0.22 110.332 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -70.09 -29.07 65.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.926 -0.579 . . . . 0.16 111.502 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.21 -52.11 60.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.458 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -71.66 -32.28 67.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.138 -0.483 . . . . 1.37 111.018 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.7 -46.69 86.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.255 -0.646 . . . . 0.17 109.255 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.26 -37.19 86.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.856 -0.611 . . . . 0.71 110.618 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . 0.451 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.0 -39.1 95.21 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.994 -0.622 . . . . 0.16 112.163 176.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -66.4 -40.26 89.52 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.535 0.683 . . . . 1.26 109.4 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.8 mp -64.68 -34.27 77.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.106 -0.952 . . . . 0.2 110.516 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.49 -46.24 83.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.772 0.32 . . . . 1.14 110.271 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 53.4 mt-30 -58.9 -47.37 85.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.554 . . . . 1.13 111.8 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.77 -45.4 17.06 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.163 0.431 . . . . 1.98 112.163 -174.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.7 mp -82.14 -22.97 35.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.259 -0.428 . . . . 0.45 112.045 -172.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.78 37.45 28.81 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.987 0.804 . . . . 2.19 110.398 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -156.71 109.92 2.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.472 -0.786 . . . . 1.11 109.845 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -67.53 -34.23 76.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.012 -0.54 . . . . 1.41 111.285 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.22 -50.93 63.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.51 -0.314 . . . . 2.0 111.098 -176.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -70.81 -27.76 64.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.019 0.438 . . . . 1.48 110.049 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.56 -37.26 84.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.583 0.706 . . . . 0.21 109.594 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.447 ' O ' HG23 ' B' ' 220' ' ' VAL . 2.9 t-20 -70.08 -46.86 64.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.185 -0.916 . . . . 0.63 110.124 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -57.85 -40.15 79.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.714 -0.676 . . . . 1.97 111.116 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.527 HD12 HD21 ' B' ' 209' ' ' LEU . 32.9 mt -73.4 -36.3 66.0 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.179 -0.464 . . . . 0.2 110.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -57.73 -43.49 85.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.152 0.501 . . . . 1.29 110.06 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.579 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 60.5 t -71.43 -49.33 47.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.457 -0.792 . . . . 0.19 109.798 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 225' ' ' ALA . 56.7 tp -56.98 -48.16 79.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.968 -1.014 . . . . 0.25 111.061 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.5 -37.56 87.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.581 -0.736 . . . . 1.24 110.235 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . 0.538 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.0 tttt -65.99 -33.84 76.72 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.86 -0.336 . . . . 0.35 110.707 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.579 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.63 64.65 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.556 -0.535 . . . . 2.27 109.556 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . 0.501 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -68.38 -42.19 79.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.394 -0.821 . . . . 0.16 109.602 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.42 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.8 t90 -63.68 -38.93 92.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.285 -0.87 . . . . 0.19 110.249 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.5 mmm180 -64.24 -34.43 78.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 2.25 110.397 176.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.1 t -77.48 -6.86 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.444 -0.344 . . . . 1.18 111.147 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 31.6 t -75.52 -16.9 60.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.452 -0.573 . . . . 0.93 109.452 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.419 -0.801 . . . . 1.27 109.966 176.98 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 26.4 t . . . . . 0 C--O 1.23 0.062 0 N-CA-C 111.637 0.236 . . . . 1.24 111.637 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.6 -33.16 58.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.553 0.216 . . . . 0.35 111.122 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.439 HG13 ' CE2' ' A' ' 197' ' ' PHE . 44.0 t -69.14 -22.55 26.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.405 0.622 . . . . 0.24 110.183 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -86.16 12.36 9.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.837 -0.62 . . . . 0.24 111.756 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 36.9 p -108.43 155.32 20.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.013 0.435 . . . . 0.26 110.844 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -65.37 -32.97 74.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.75 -0.659 . . . . 2.46 109.262 174.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.01 -41.88 88.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.035 -0.984 . . . . 0.26 111.982 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . 0.446 ' CE1' HD11 ' B' ' 209' ' ' LEU . 54.2 t80 -64.3 -50.35 68.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.726 -0.39 . . . . 0.22 110.557 -179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.1 -28.5 66.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.071 -0.513 . . . . 0.17 110.97 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -63.74 -49.7 72.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.998 -0.547 . . . . 1.23 110.433 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -70.94 -34.09 71.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.207 -0.452 . . . . 1.37 110.929 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 205' ' ' LEU . 2.9 tm? -60.21 -48.04 83.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.957 -0.565 . . . . 0.18 109.739 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.442 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 47.1 tt0 -68.8 -34.7 75.96 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.677 -0.409 . . . . 0.71 110.364 176.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.09 95.41 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.16 111.773 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -67.62 -38.39 83.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 4.9 mp -66.03 -37.35 85.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.832 -0.622 . . . . 0.19 110.608 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -64.09 -47.36 80.35 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.713 0.292 . . . . 1.13 110.552 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -66.85 -43.23 84.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.177 -0.465 . . . . 1.13 111.77 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 8.7 tpt85 -75.15 -48.44 23.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.915 0.388 . . . . 1.97 111.308 -175.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -77.24 -22.07 52.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.912 -0.585 . . . . 0.45 112.172 -176.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 63.11 32.46 15.21 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 124.131 0.895 . . . . 2.19 110.509 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.17 118.69 4.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 1.12 110.426 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -67.96 -40.06 83.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 1.42 112.085 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -62.2 -51.37 68.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.591 -0.277 . . . . 2.01 111.16 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.73 -28.26 64.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.358 -0.383 . . . . 1.48 110.462 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.58 -40.86 84.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.423 0.63 . . . . 0.2 109.975 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.423 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.2 t-20 -69.05 -45.53 70.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.122 -0.944 . . . . 0.63 109.78 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.55 -40.49 87.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.364 -0.835 . . . . 1.99 111.149 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . 0.472 HD12 HD21 ' A' ' 209' ' ' LEU . 45.6 mt -72.77 -36.87 67.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.406 -0.361 . . . . 0.2 110.238 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 40.6 ttp180 -56.43 -42.13 77.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.213 0.53 . . . . 1.29 110.172 175.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.589 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 99.5 t -71.33 -49.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.665 -0.698 . . . . 0.19 109.925 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 50.2 tp -56.63 -49.7 74.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.922 -1.036 . . . . 0.26 111.095 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -64.61 -36.93 85.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.224 -0.898 . . . . 1.25 110.491 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -68.57 -29.87 68.52 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.739 -0.384 . . . . 0.36 111.018 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 48.6 mt-10 -73.23 -33.78 65.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.311 -0.626 . . . . 2.28 109.311 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.82 -40.29 79.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.41 -0.813 . . . . 0.16 109.835 177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 58.1 t90 -65.13 -41.94 94.35 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.126 -0.943 . . . . 0.19 110.148 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -63.97 -37.98 89.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.043 -0.526 . . . . 2.25 111.089 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 43.4 m -73.71 -5.22 39.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.768 0.318 . . . . 1.16 111.641 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 64.0 m -85.75 -9.46 57.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.181 0.515 . . . . 0.93 110.412 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.685 -0.674 . . . . 1.27 109.748 176.901 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 25.9 t . . . . . 0 CA--C 1.528 0.105 0 CA-C-O 120.66 0.266 . . . . 1.24 111.632 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.6 p -68.53 -32.95 57.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.657 0.265 . . . . 0.34 111.092 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.432 HG13 ' CE2' ' B' ' 197' ' ' PHE . 43.6 t -69.24 -22.64 26.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.264 0.554 . . . . 0.23 110.256 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.403 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.29 12.14 10.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.867 -0.606 . . . . 0.23 111.625 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 35.8 p -108.15 155.31 20.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.917 0.389 . . . . 0.25 110.753 -175.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.38 -32.99 74.92 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.238 -0.653 . . . . 2.46 109.238 174.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.98 88.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.141 -0.936 . . . . 0.27 111.83 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 209' ' ' LEU . 54.4 t80 -64.18 -50.43 68.15 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.658 -0.417 . . . . 0.22 110.565 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.13 -28.36 66.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.1 -0.5 . . . . 0.16 110.972 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -63.76 -49.86 71.34 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 1.25 110.481 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.84 -34.02 71.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.284 -0.417 . . . . 1.37 110.867 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . 0.412 ' O ' HD13 ' B' ' 205' ' ' LEU . 2.9 tm? -60.15 -48.01 83.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.17 109.726 177.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.466 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 47.3 tt0 -68.81 -35.09 76.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.407 -0.36 . . . . 0.71 110.399 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -57.95 -41.97 94.58 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.827 -0.701 . . . . 0.16 111.742 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.96 -38.04 82.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.722 -0.473 . . . . 1.26 109.722 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 4.9 mp -66.44 -37.17 84.58 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.862 -0.608 . . . . 0.2 110.652 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -63.96 -47.81 78.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.781 0.324 . . . . 1.14 110.532 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -66.43 -43.22 86.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 1.13 111.878 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -75.18 -48.45 23.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.831 0.348 . . . . 1.98 111.295 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.9 mp -77.34 -21.88 52.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.98 -0.555 . . . . 0.45 112.171 -176.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 62.85 32.48 15.8 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 124.135 0.897 . . . . 2.19 110.593 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -155.15 118.57 4.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 1.11 110.285 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.86 -40.07 83.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.953 -0.567 . . . . 1.41 112.069 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -62.23 -51.13 69.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.648 0.261 . . . . 2.0 111.191 -174.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.01 -28.17 64.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.886 0.374 . . . . 1.48 110.422 -177.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.54 -41.01 84.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.506 0.669 . . . . 0.21 109.958 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.422 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.4 t-20 -69.13 -45.55 69.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.095 -0.957 . . . . 0.63 109.757 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.39 -40.42 86.54 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.404 -0.816 . . . . 1.97 111.245 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . 0.478 HD12 HD21 ' B' ' 209' ' ' LEU . 45.5 mt -72.79 -36.87 67.68 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.336 -0.393 . . . . 0.2 110.284 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . 0.466 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 40.8 ttp180 -56.46 -42.21 77.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.18 0.514 . . . . 1.29 110.125 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.578 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 97.2 t -71.28 -49.66 46.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.634 -0.712 . . . . 0.19 109.969 -178.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 50.0 tp -56.62 -49.43 75.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.908 -1.042 . . . . 0.25 111.115 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -64.8 -37.3 87.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.201 -0.909 . . . . 1.24 110.324 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -68.3 -30.06 68.96 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.758 -0.377 . . . . 0.35 110.908 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 48.3 mt-10 -73.22 -33.24 65.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.415 -0.587 . . . . 2.27 109.415 178.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.17 77.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.399 -0.818 . . . . 0.16 109.701 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.403 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 58.4 t90 -65.32 -41.85 93.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.187 177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -64.13 -37.81 88.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.53 . . . . 2.25 111.146 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 43.8 m -73.99 -4.74 37.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.508 -0.314 . . . . 1.18 111.693 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 66.3 m -85.88 -9.79 56.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.118 0.485 . . . . 0.93 110.426 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.553 -0.737 . . . . 1.27 109.917 177.05 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.9 t . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.468 0.175 . . . . 1.24 110.65 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.0 p -70.59 -33.92 55.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-O 120.82 0.343 . . . . 0.35 110.78 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' VAL . . . . . 0.455 HG13 ' CE2' ' A' ' 197' ' ' PHE . 39.0 t -71.48 -19.75 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.704 0.764 . . . . 0.24 109.679 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' ALA . . . . . 0.468 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.14 11.59 11.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.468 -0.787 . . . . 0.24 111.466 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.9 p -106.02 151.22 24.92 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.26 110.193 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -65.76 -32.9 74.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.7 -0.682 . . . . 2.46 109.304 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.55 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.925 -1.034 . . . . 0.26 111.782 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' PHE . . . . . 0.455 ' CE2' HG13 ' A' ' 192' ' ' VAL . 57.1 t80 -62.22 -50.23 72.59 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.737 0.303 . . . . 0.22 110.244 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -68.75 -28.86 67.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.785 -0.643 . . . . 0.17 111.51 -177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.94 -47.82 73.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.68 0.276 . . . . 1.23 110.386 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -66.64 -37.44 84.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.956 0.407 . . . . 1.37 110.598 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.89 -47.69 84.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.757 . . . . 0.18 109.867 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' GLN . . . . . 0.548 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 53.1 tt0 -69.04 -31.88 70.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.341 -0.391 . . . . 0.71 110.478 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.78 -41.34 99.61 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.16 111.509 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.0 -37.84 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.68 -0.489 . . . . 1.26 109.68 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.0 mp -66.78 -35.97 81.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.676 -0.693 . . . . 0.19 110.793 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.02 -46.95 82.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.77 0.319 . . . . 1.13 110.677 176.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -66.62 -41.46 88.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.094 -0.503 . . . . 1.13 111.768 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.0 tpt85 -74.69 -48.99 22.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.893 0.377 . . . . 1.97 111.387 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -80.73 -22.58 40.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.659 0.614 . . . . 0.45 112.659 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 14.4 mptt 62.99 35.09 13.46 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.679 0.612 . . . . 2.19 110.626 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -156.61 118.95 3.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.058 0.456 . . . . 1.12 110.592 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -67.97 -40.12 83.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.511 -0.768 . . . . 1.42 111.818 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 217' ' ' LYS . 6.5 m-20 -62.46 -51.34 67.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.377 . . . . 2.01 111.307 -173.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -70.81 -31.06 67.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.919 0.39 . . . . 1.48 110.313 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.61 -39.44 91.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.2 110.132 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -70.29 -47.36 61.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.63 110.1 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 213' ' ' ASP . 68.0 mttm -60.91 -37.01 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.775 -0.648 . . . . 1.99 111.094 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 44.4 mt -72.48 -39.97 67.28 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.306 -0.407 . . . . 0.2 110.271 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' ARG . . . . . 0.548 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 37.2 ttp180 -55.16 -42.31 72.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.142 0.496 . . . . 1.29 110.288 176.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' VAL . . . . . 0.635 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 85.9 t -71.13 -49.56 47.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.558 -0.746 . . . . 0.19 109.851 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.89 -48.5 78.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.937 -1.029 . . . . 0.26 111.025 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.14 -36.96 85.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 1.25 110.317 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -67.46 -31.73 72.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.36 110.846 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 44.3 mt-10 -75.42 -31.48 60.39 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.466 -0.568 . . . . 2.28 109.466 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.15 -41.63 77.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.428 -0.806 . . . . 0.16 109.662 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 226' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 56.0 t90 -64.38 -37.74 88.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.165 -0.925 . . . . 0.19 110.1 177.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.77 -35.0 79.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.227 -0.442 . . . . 2.25 110.756 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 19.7 t -74.95 -9.68 58.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.938 0.399 . . . . 1.16 110.923 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 23.2 t -75.42 -12.51 60.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.166 0.508 . . . . 0.93 110.229 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.651 -0.69 . . . . 1.27 110.327 178.773 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.639 0.256 . . . . 1.24 110.721 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.59 -34.18 56.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.34 110.809 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 192' ' ' VAL . . . . . 0.458 HG13 ' CE2' ' B' ' 197' ' ' PHE . 39.1 t -71.38 -19.63 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.688 0.756 . . . . 0.23 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 193' ' ' ALA . . . . . 0.466 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.15 11.57 11.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.431 -0.804 . . . . 0.23 111.642 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.6 p -106.05 151.35 24.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.022 0.439 . . . . 0.25 110.165 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.99 -32.88 74.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.637 -0.71 . . . . 2.46 109.245 175.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.68 92.76 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.873 -1.058 . . . . 0.27 111.691 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 197' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' B' ' 192' ' ' VAL . 56.0 t80 -62.25 -50.26 72.44 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.894 0.378 . . . . 0.22 110.093 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.7 -28.91 67.26 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.624 -0.716 . . . . 0.16 111.558 -177.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.88 -47.9 73.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.722 0.296 . . . . 1.25 110.38 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -66.39 -37.71 85.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.995 0.426 . . . . 1.37 110.387 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.74 -47.8 84.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.655 -0.702 . . . . 0.17 109.931 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.543 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 53.6 tt0 -68.95 -31.81 70.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.369 -0.378 . . . . 0.71 110.5 178.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.82 -41.45 99.63 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.749 -0.739 . . . . 0.16 111.512 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.8 -38.0 85.64 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.691 -0.485 . . . . 1.26 109.691 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.0 mp -66.63 -36.03 81.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.2 110.806 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -64.03 -46.76 83.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.82 0.343 . . . . 1.14 110.6 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.8 -41.25 87.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 1.13 111.926 -178.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -74.87 -49.11 21.59 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.833 0.349 . . . . 1.98 111.292 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 209' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.0 mp -80.67 -22.66 40.24 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.524 0.564 . . . . 0.45 112.524 -175.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 14.3 mptt 62.95 34.98 13.66 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.658 0.599 . . . . 2.19 110.717 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -156.56 118.86 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.076 0.465 . . . . 1.11 110.536 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -67.97 -40.26 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.551 -0.749 . . . . 1.41 111.866 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.12 -51.44 67.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 2.0 111.34 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -70.8 -31.04 67.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.923 0.392 . . . . 1.48 110.274 -178.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.69 -39.4 91.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.412 0.625 . . . . 0.21 110.025 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 216' ' ' ASN . . . . . 0.464 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.3 t-20 -70.25 -47.45 61.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.208 -0.905 . . . . 0.63 110.099 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.9 -37.04 80.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.77 -0.65 . . . . 1.97 111.013 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.1 mt -72.43 -40.01 67.42 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.325 -0.398 . . . . 0.2 110.203 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 219' ' ' ARG . . . . . 0.543 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 36.9 ttp180 -55.14 -42.18 72.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.088 0.47 . . . . 1.29 110.299 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 220' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 79.0 t -71.27 -49.59 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.19 109.816 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 60.7 tp -56.73 -48.73 77.11 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.961 -1.018 . . . . 0.25 111.039 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.01 -37.01 86.23 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.462 -0.79 . . . . 1.24 110.291 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.32 -31.96 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.012 -0.275 . . . . 0.35 110.801 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 224' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 43.8 mt-10 -75.21 -31.65 60.95 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.525 -0.546 . . . . 2.27 109.525 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.87 -41.68 78.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.523 -0.762 . . . . 0.16 109.65 175.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 226' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 56.3 t90 -64.39 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.251 -0.886 . . . . 0.19 110.132 177.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.9 -34.87 78.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 2.25 110.658 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 24.2 t -74.63 -10.26 59.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.8 0.333 . . . . 1.18 110.891 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.1 t -75.24 -12.56 60.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.181 0.515 . . . . 0.93 110.371 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.636 -0.697 . . . . 1.27 110.467 178.667 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo . . . . . 0 N--CA 1.481 0.755 0 N-CA-C 110.851 -0.48 . . . . 1.91 110.851 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 28.8 p -80.94 -21.83 40.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 2.1 111.181 174.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.431 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 108.76 67.98 0.61 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.715 -0.755 . . . . 1.67 112.572 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -167.52 -55.18 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.09 0.471 . . . . 1.96 110.182 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 18.2 m -60.72 -36.5 78.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.767 -0.651 . . . . 1.24 110.954 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.29 -33.92 47.65 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 CA-C-O 120.779 0.323 . . . . 0.35 110.377 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.476 HG22 HD11 ' B' ' 209' ' ' LEU . 22.3 t -69.89 -19.69 22.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.678 0.751 . . . . 0.24 109.73 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.515 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.21 12.04 10.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.546 -0.752 . . . . 0.24 111.522 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 34.1 p -108.98 146.28 34.12 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.485 0.66 . . . . 0.26 110.562 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.95 -31.57 72.57 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 2.46 110.012 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.18 -40.5 94.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.4 -0.818 . . . . 0.26 111.427 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.14 -49.98 73.69 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.338 -0.392 . . . . 0.22 109.943 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.82 -29.22 67.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.61 -0.723 . . . . 0.17 111.845 -177.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.38 -48.3 70.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.799 0.333 . . . . 1.23 110.232 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.32 -33.84 73.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 1.37 110.928 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.14 -47.13 86.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.921 -0.581 . . . . 0.18 109.609 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.445 ' HB2' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.6 -32.19 72.76 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.438 -0.347 . . . . 0.71 110.2 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.02 -41.7 96.57 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.959 -0.639 . . . . 0.16 111.735 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.14 -41.13 90.87 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.441 0.638 . . . . 1.26 109.534 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.425 HD23 ' HB2' ' A' ' 218' ' ' LEU . 3.0 mp -63.59 -37.93 89.21 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.094 -0.957 . . . . 0.19 110.434 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -66.76 -42.88 85.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.66 -0.245 . . . . 1.13 110.664 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 49.7 mt-30 -57.51 -46.07 84.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.878 0.37 . . . . 1.13 111.567 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.96 -41.32 20.97 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.484 0.55 . . . . 1.97 112.484 -175.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.47 HD11 HG22 ' B' ' 192' ' ' VAL . 8.3 mp -86.26 -22.46 26.83 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.049 0.389 . . . . 0.45 112.049 -172.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.53 39.61 17.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.622 -0.717 . . . . 2.19 110.991 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -157.99 117.33 3.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.955 0.407 . . . . 1.12 110.221 -177.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.58 -44.29 82.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.569 -0.741 . . . . 1.42 111.778 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -69.72 -40.67 76.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.532 -0.304 . . . . 2.01 111.142 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 4.6 tp10 -68.31 -40.21 81.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.329 0.585 . . . . 1.48 109.866 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.54 -32.71 74.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.403 -0.817 . . . . 0.2 109.887 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.9 t-20 -69.76 -44.22 70.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.996 -1.002 . . . . 0.63 110.006 178.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -56.58 -42.65 79.03 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.389 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.425 ' HB2' HD23 ' A' ' 205' ' ' LEU . 53.7 mt -72.84 -35.18 67.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.656 -0.702 . . . . 0.2 110.502 -177.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 202' ' ' GLN . 50.2 ttp180 -57.89 -42.99 85.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.03 0.443 . . . . 1.29 110.271 176.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 60.5 t -71.23 -49.08 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.639 -0.71 . . . . 0.19 109.806 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.409 HD21 ' O ' ' B' ' 225' ' ' ALA . 65.2 tp -57.36 -49.52 75.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.701 -1.136 . . . . 0.26 110.964 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -66.3 -36.92 84.19 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.778 -0.647 . . . . 1.25 110.706 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 88.0 tttt -66.71 -34.54 78.08 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.67 -0.412 . . . . 0.36 110.824 179.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 10.9 mm-40 -75.79 -30.49 59.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.135 0.493 . . . . 2.28 109.822 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.37 -42.94 82.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.592 -0.731 . . . . 0.16 109.482 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 36.6 t90 -63.28 -36.2 82.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.121 -0.945 . . . . 0.19 110.096 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.572 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.7 82.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.263 -0.426 . . . . 2.25 110.626 175.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 14.5 t -76.61 -9.29 58.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.201 -0.454 . . . . 1.16 110.785 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 35.1 t -75.19 -12.03 60.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.193 0.52 . . . . 0.93 110.348 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.695 -0.669 . . . . 1.27 110.355 178.07 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo . . . . . 0 N--CA 1.479 0.665 0 N-CA-C 110.856 -0.478 . . . . 1.89 110.856 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 32.7 p -80.16 -22.57 41.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 2.1 111.027 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.428 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 109.24 68.35 0.61 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.676 -0.773 . . . . 1.68 112.503 178.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -167.96 -55.24 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.116 0.484 . . . . 1.97 110.058 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 17.1 m -60.59 -36.71 79.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.841 -0.618 . . . . 1.24 110.834 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 11.2 p -72.13 -33.99 48.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 CA-C-O 120.721 0.296 . . . . 0.34 110.269 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.47 HG22 HD11 ' A' ' 209' ' ' LEU . 22.2 t -69.82 -19.68 22.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.573 0.701 . . . . 0.23 109.736 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.518 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.16 11.84 11.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.623 -0.717 . . . . 0.23 111.486 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 34.4 p -108.87 146.17 34.15 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.572 0.701 . . . . 0.25 110.457 -175.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.79 -31.72 72.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.768 -1.105 . . . . 2.46 109.939 176.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.1 -40.29 93.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.518 -0.764 . . . . 0.27 111.487 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.34 -50.1 72.97 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.332 -0.395 . . . . 0.22 109.991 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -68.71 -29.29 67.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.594 -0.73 . . . . 0.16 111.861 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.3 -48.48 70.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.8 0.333 . . . . 1.25 110.155 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.16 -33.95 74.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.378 -0.374 . . . . 1.37 110.784 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -58.99 -47.16 86.18 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.003 -0.544 . . . . 0.17 109.589 175.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.433 ' HB2' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.67 -32.07 72.48 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 116.459 -0.337 . . . . 0.71 110.328 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.628 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.25 -41.55 96.83 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.968 -0.634 . . . . 0.16 111.594 175.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -66.21 -41.12 90.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.413 0.625 . . . . 1.26 109.509 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.415 HD23 ' HB2' ' B' ' 218' ' ' LEU . 3.0 mp -63.49 -38.06 89.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.108 -0.951 . . . . 0.2 110.54 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -66.64 -43.16 85.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.672 -0.24 . . . . 1.14 110.552 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.628 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 49.7 mt-30 -57.21 -46.13 83.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.429 -0.35 . . . . 1.13 111.588 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -82.09 -41.17 20.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.425 0.528 . . . . 1.98 112.425 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.476 HD11 HG22 ' A' ' 192' ' ' VAL . 8.4 mp -86.26 -22.68 26.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.982 0.364 . . . . 0.45 111.982 -172.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 60.45 40.07 17.63 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.909 0.756 . . . . 2.19 110.758 -177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -158.2 117.37 3.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.888 0.375 . . . . 1.11 110.319 -177.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -66.6 -44.28 82.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.604 -0.726 . . . . 1.41 111.801 -177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.75 -41.05 75.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.445 -0.343 . . . . 2.0 111.045 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 4.5 tp10 -67.98 -40.28 83.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.437 0.637 . . . . 1.48 110.002 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.8 74.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.393 -0.821 . . . . 0.21 109.915 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.414 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.56 -44.57 70.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.107 -0.952 . . . . 0.63 110.028 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -56.23 -42.93 78.08 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 116.137 -0.483 . . . . 1.97 110.377 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.415 ' HB2' HD23 ' B' ' 205' ' ' LEU . 54.2 mt -72.77 -35.04 67.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.689 -0.687 . . . . 0.2 110.578 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . 0.433 ' HD3' ' HB2' ' B' ' 202' ' ' GLN . 50.1 ttp180 -57.83 -43.2 85.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.101 0.477 . . . . 1.29 110.18 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 59.6 t -71.16 -49.07 51.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.708 -0.678 . . . . 0.19 109.891 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.3 tp -57.23 -49.75 75.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.756 -1.111 . . . . 0.25 111.035 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -66.24 -36.79 83.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.76 -0.654 . . . . 1.24 110.731 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.557 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 87.9 tttt -66.84 -34.5 77.95 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.663 -0.415 . . . . 0.35 110.795 179.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 12.0 mm-40 -75.75 -30.2 59.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.095 0.474 . . . . 2.27 109.796 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -67.64 -42.87 81.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.539 -0.755 . . . . 0.16 109.458 174.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.518 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 36.9 t90 -63.33 -36.23 82.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.207 -0.906 . . . . 0.19 110.151 176.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.3 mmm180 -61.9 -36.99 82.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 2.25 110.386 175.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 19.5 t -76.36 -9.15 58.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.261 -0.427 . . . . 1.18 110.871 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 33.5 t -75.35 -11.81 60.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.057 0.456 . . . . 0.93 110.313 178.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.606 -0.711 . . . . 1.27 110.406 177.712 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.478 0.611 0 N-CA-C 110.17 -0.742 . . . . 1.91 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 18.0 t -118.9 60.13 0.82 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.276 0.56 . . . . 2.1 110.475 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . . . . . . . . . . . 112.85 -109.04 2.27 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.62 -0.8 . . . . 1.67 113.105 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -56.73 -44.28 81.48 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.458 0.54 . . . . 1.96 112.458 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.7 t -42.45 -42.18 3.18 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.28 0.844 . . . . 1.24 113.28 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 14.8 p -86.74 -31.41 6.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.284 -0.567 . . . . 0.35 111.009 -178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.461 HG22 HD11 ' B' ' 209' ' ' LEU . 28.1 t -68.28 -21.38 26.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.366 0.603 . . . . 0.24 110.231 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.46 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.28 11.36 12.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.99 -0.55 . . . . 0.24 111.354 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 46.1 p -106.32 145.66 31.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.279 0.561 . . . . 0.26 109.998 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -65.45 -32.4 74.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.189 -0.914 . . . . 2.46 109.692 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.76 -37.87 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.366 -0.833 . . . . 0.26 111.745 175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -62.68 -50.8 69.72 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.967 -0.383 . . . . 0.22 109.967 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.18 -29.38 67.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.635 -0.711 . . . . 0.17 111.553 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.88 -48.75 70.49 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.028 0.442 . . . . 1.23 110.316 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -72.45 -32.54 66.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 1.37 110.938 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.46 -47.1 85.13 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.037 -0.727 . . . . 0.18 109.037 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.46 ' HB2' ' HD2' ' A' ' 219' ' ' ARG . 49.8 tt0 -66.05 -33.84 76.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.145 -0.479 . . . . 0.71 110.299 176.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.493 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -61.41 -39.82 97.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.829 -0.701 . . . . 0.16 112.068 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.45 -38.64 87.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.542 0.687 . . . . 1.26 109.258 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.0 mp -65.55 -33.6 76.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.686 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.01 -43.63 87.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.869 0.366 . . . . 1.13 110.476 175.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 51.4 mt-30 -59.99 -46.99 87.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.989 -0.551 . . . . 1.13 111.532 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 208' ' ' ARG . 9.7 mmt180 -79.29 -47.02 16.6 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.431 0.53 . . . . 1.97 112.431 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.49 HD21 HD12 ' A' ' 218' ' ' LEU . 8.7 mp -81.87 -21.95 37.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.346 -0.388 . . . . 0.45 111.858 -172.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.56 35.31 20.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 2.19 110.658 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -157.93 118.79 3.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 1.12 110.128 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -68.15 -37.4 81.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.625 -0.716 . . . . 1.42 111.496 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.11 -50.12 62.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.236 -0.438 . . . . 2.01 111.294 -175.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.71 -33.1 74.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.171 0.51 . . . . 1.48 109.925 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.4 87.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.531 0.682 . . . . 0.2 110.115 178.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -69.68 -43.02 73.35 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.248 -0.887 . . . . 0.63 109.759 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.43 -37.8 84.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.566 -0.743 . . . . 1.99 111.215 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.49 HD12 HD21 ' A' ' 209' ' ' LEU . 32.5 mt -72.71 -36.34 67.8 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.829 -0.348 . . . . 0.2 110.44 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 202' ' ' GLN . 64.4 ttt180 -57.25 -41.97 80.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.099 0.476 . . . . 1.29 110.358 175.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.4 t -70.45 -48.71 58.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.666 -0.697 . . . . 0.19 109.968 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.28 -48.71 80.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.995 -1.002 . . . . 0.26 110.845 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.69 83.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.684 -0.689 . . . . 1.25 110.538 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.552 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.8 tttt -67.66 -33.89 75.85 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.705 -0.398 . . . . 0.36 110.798 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 28.3 mm-40 -74.58 -30.64 61.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 2.28 109.69 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.27 -41.35 85.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 0.16 109.411 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.46 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.0 t90 -65.11 -39.36 92.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.066 -0.97 . . . . 0.19 109.963 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.2 mmm180 -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.086 -0.506 . . . . 2.25 111.09 176.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.08 -4.62 36.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.148 0.499 . . . . 1.16 110.972 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 24.3 t -80.22 -14.46 58.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.493 -0.558 . . . . 0.93 109.493 176.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.717 -0.659 . . . . 1.27 110.048 177.631 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.477 0.55 0 N-CA-C 110.284 -0.699 . . . . 1.89 110.284 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 19.8 t -118.72 59.77 0.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 2.1 110.434 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 113.17 -109.09 2.25 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.707 -0.759 . . . . 1.68 113.054 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -56.49 -44.41 80.63 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.529 0.566 . . . . 1.97 112.529 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 31.9 t -42.55 -41.61 3.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.239 0.829 . . . . 1.24 113.239 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 14.9 p -87.18 -31.45 5.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.238 -0.585 . . . . 0.34 111.125 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.443 HG22 HD11 ' A' ' 209' ' ' LEU . 27.7 t -68.11 -21.37 26.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.498 0.666 . . . . 0.23 110.381 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.52 11.67 12.11 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.907 -0.588 . . . . 0.23 111.373 -177.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 45.1 p -106.34 145.88 31.12 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.245 0.545 . . . . 0.25 110.019 -175.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.71 -32.3 73.78 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.136 -0.938 . . . . 2.46 109.678 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.93 84.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.349 -0.841 . . . . 0.27 111.578 176.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.73 -50.75 69.87 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.902 -0.407 . . . . 0.22 109.902 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -69.12 -29.4 67.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.634 -0.712 . . . . 0.16 111.662 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -66.14 -48.52 70.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.04 0.448 . . . . 1.25 110.336 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -72.51 -32.57 66.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.226 -0.443 . . . . 1.37 110.95 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . 0.401 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.9 tm? -58.51 -47.15 85.09 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.108 -0.701 . . . . 0.17 109.108 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.474 ' HB2' ' HD2' ' B' ' 219' ' ' ARG . 50.0 tt0 -65.93 -34.03 77.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.71 110.322 176.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.484 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -61.06 -40.37 98.42 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.827 -0.701 . . . . 0.16 112.051 176.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -66.0 -38.61 88.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.646 0.736 . . . . 1.26 109.2 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 2.9 mp -65.58 -33.57 76.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.936 -1.029 . . . . 0.2 110.719 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.93 -44.23 85.72 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.837 0.351 . . . . 1.14 110.411 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 50.2 mt-30 -59.48 -47.0 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.984 -0.553 . . . . 1.13 111.636 179.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -79.38 -47.11 16.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.289 0.478 . . . . 1.98 112.289 -175.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.487 HD21 HD12 ' B' ' 218' ' ' LEU . 8.7 mp -81.65 -21.94 37.85 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.845 0.313 . . . . 0.45 111.845 -172.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 60.28 35.6 20.78 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 124.098 0.874 . . . . 2.19 110.574 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -158.06 118.71 3.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 1.11 110.214 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -68.08 -37.54 81.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.665 -0.698 . . . . 1.41 111.525 -176.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.94 -49.93 63.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.199 -0.455 . . . . 2.0 111.326 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -68.03 -33.13 74.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.038 -0.528 . . . . 1.48 109.965 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.39 87.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 0.21 110.095 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.482 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.1 t-20 -69.63 -43.14 73.3 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.372 -0.831 . . . . 0.63 109.792 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -61.38 -37.89 85.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.462 -0.79 . . . . 1.97 111.103 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.487 HD12 HD21 ' B' ' 209' ' ' LEU . 32.4 mt -72.59 -36.53 68.17 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.772 -0.371 . . . . 0.2 110.348 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . 0.474 ' HD2' ' HB2' ' B' ' 202' ' ' GLN . 64.0 ttt180 -56.98 -42.08 79.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.064 0.459 . . . . 1.29 110.244 175.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 216' ' ' ASN . 80.1 t -70.48 -48.61 58.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.19 109.946 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.7 tp -59.46 -48.53 81.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.956 -1.02 . . . . 0.25 110.817 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -67.23 -37.87 84.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.643 -0.708 . . . . 1.24 110.646 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.561 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.8 tttt -67.45 -34.12 76.55 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.799 -0.361 . . . . 0.35 110.79 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 28.4 mm-40 -74.61 -30.55 61.72 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.223 0.535 . . . . 2.27 109.728 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.19 -41.26 86.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.483 -0.781 . . . . 0.16 109.452 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.6 t90 -65.14 -39.33 92.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.02 -0.991 . . . . 0.19 109.984 177.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.561 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.3 mmm180 -64.6 -40.16 95.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 2.25 111.075 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.2 t -74.06 -4.94 38.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.046 0.45 . . . . 1.18 110.905 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.4 t -79.76 -14.85 58.42 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.65 -0.5 . . . . 0.93 109.65 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.625 -0.702 . . . . 1.27 110.094 177.655 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.475 0.422 0 N-CA-C 110.466 -0.628 . . . . 1.91 110.466 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.9 t -132.5 60.98 1.68 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.909 -0.774 . . . . 2.1 108.909 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.416 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 90.09 -154.71 23.9 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 115.292 -0.867 . . . . 1.67 111.876 -174.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 30.82 -82.14 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.594 1.558 . . . . 1.96 114.986 175.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 8.7 m -46.51 -45.94 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.327 0.651 . . . . 1.24 112.497 -175.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.585 HG11 ' HA ' ' B' ' 209' ' ' LEU . 7.5 p -75.29 -30.35 22.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.35 110.812 -179.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 40.4 t -69.6 -20.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.565 0.698 . . . . 0.24 109.701 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.431 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.33 10.95 13.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.574 -0.739 . . . . 0.24 111.404 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 40.1 p -106.56 144.47 33.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.211 0.529 . . . . 0.26 110.005 -175.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.93 -31.23 72.03 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.278 -0.874 . . . . 2.46 109.429 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.65 89.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.106 -0.952 . . . . 0.26 111.247 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -61.71 -48.44 80.74 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.938 0.399 . . . . 0.22 109.971 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.78 -28.67 66.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.572 -0.74 . . . . 0.17 111.664 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -66.37 -48.99 68.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.834 0.349 . . . . 1.23 110.358 174.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.36 -37.91 86.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.05 0.452 . . . . 1.37 110.682 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.18 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.585 -0.734 . . . . 0.18 109.735 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.447 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 60.9 tt0 -64.2 -36.75 85.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.025 -0.534 . . . . 0.71 110.387 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.522 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.0 -41.79 98.07 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.034 -0.603 . . . . 0.16 112.069 177.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -66.56 -39.07 88.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.172 0.51 . . . . 1.26 109.637 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.609 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.5 mp -64.98 -34.15 77.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.565 -0.743 . . . . 0.19 110.539 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 47.3 mt-10 -65.97 -43.98 86.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.674 0.274 . . . . 1.13 110.488 176.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 46.3 mt-30 -62.85 -48.81 77.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.433 . . . . 1.13 111.691 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.8 tpt85 -77.87 -43.61 29.66 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.989 -0.551 . . . . 1.97 111.531 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.609 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 3.1 mp -84.25 -23.29 30.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.243 -0.435 . . . . 0.45 112.16 -176.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.37 36.27 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 123.84 0.713 . . . . 2.19 111.133 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -156.88 117.09 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.994 -0.548 . . . . 1.12 110.266 -177.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -67.79 -37.19 81.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.684 -0.689 . . . . 1.42 111.355 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -62.58 -50.18 72.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.318 -0.401 . . . . 2.01 110.917 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.49 -37.62 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.972 -0.558 . . . . 1.48 110.005 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.11 -41.65 90.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.82 -0.627 . . . . 0.2 110.618 -176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 220' ' ' VAL . 0.2 OUTLIER -70.87 -41.94 70.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.597 -0.728 . . . . 0.63 110.253 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -59.95 -43.07 95.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.013 -0.54 . . . . 1.99 110.684 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.426 HD12 HD21 ' A' ' 209' ' ' LEU . 63.1 mt -72.91 -34.86 66.88 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.744 -0.662 . . . . 0.2 110.196 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -57.42 -44.32 84.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.134 0.492 . . . . 1.29 110.036 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 216' ' ' ASN . 73.4 t -71.68 -49.23 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.674 -0.694 . . . . 0.19 110.28 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.69 -48.68 80.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.028 -0.987 . . . . 0.26 110.783 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -65.23 -38.85 91.69 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.649 -0.705 . . . . 1.25 110.585 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 84.3 tttt -65.75 -33.84 76.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.841 -0.343 . . . . 0.36 110.866 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -76.97 -29.33 55.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.944 0.402 . . . . 2.28 110.248 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.74 87.25 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.767 -0.652 . . . . 0.16 109.358 173.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.431 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 52.7 t90 -63.61 -37.1 86.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.061 -0.972 . . . . 0.19 109.965 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 37.1 mmt180 -62.34 -37.85 87.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.157 -0.474 . . . . 2.25 110.686 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 18.4 t -75.23 -10.05 59.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.308 -0.406 . . . . 1.16 110.962 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.2 t -76.61 -7.35 55.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.037 0.446 . . . . 0.93 109.89 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.708 -0.663 . . . . 1.27 109.894 175.867 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.477 0.508 0 N-CA-C 110.572 -0.588 . . . . 1.89 110.572 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 22.7 t -132.61 61.03 1.68 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.943 -0.762 . . . . 2.1 108.943 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.439 ' HA2' ' HG ' ' A' ' 209' ' ' LEU . . . 89.7 -154.66 24.17 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.504 -0.771 . . . . 1.68 111.859 -174.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 31.05 -82.19 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.462 1.505 . . . . 1.97 114.888 175.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 6.9 m -46.62 -46.09 19.48 Favored 'General case' 0 N--CA 1.462 0.139 0 C-N-CA 123.337 0.655 . . . . 1.24 112.409 -175.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.515 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.5 p -74.95 -30.68 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.794 0.331 . . . . 0.34 110.868 -178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.48 -20.79 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.681 0.753 . . . . 0.23 109.74 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.434 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.04 10.9 12.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.42 -0.809 . . . . 0.23 111.551 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 41.5 p -106.75 144.3 33.6 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.216 0.531 . . . . 0.25 109.968 -175.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -65.86 -31.33 72.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.253 -0.885 . . . . 2.46 109.373 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.72 89.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.121 -0.945 . . . . 0.27 111.356 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -61.63 -48.48 80.67 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.941 -0.392 . . . . 0.22 109.941 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.67 -28.59 67.01 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.666 -0.697 . . . . 0.16 111.707 -177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.44 -48.99 68.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.72 0.295 . . . . 1.25 110.385 174.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -66.31 -37.97 86.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.966 0.412 . . . . 1.37 110.737 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.2 -47.0 86.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 0.17 109.646 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 61.1 tt0 -63.85 -36.95 85.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.71 110.459 177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.513 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.18 -41.74 98.32 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.104 -0.569 . . . . 0.16 111.996 177.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -66.48 -39.11 88.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.62 -0.511 . . . . 1.26 109.62 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.4 mp -64.96 -34.1 77.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.623 -0.717 . . . . 0.2 110.434 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 45.2 mt-10 -66.22 -43.49 86.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.734 0.302 . . . . 1.14 110.499 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 46.7 mt-30 -63.22 -48.92 76.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.019 0.437 . . . . 1.13 111.808 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 3.9 tpt85 -77.81 -43.47 30.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.959 -0.564 . . . . 1.98 111.456 -173.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 2.9 mp -84.17 -23.51 30.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.227 -0.442 . . . . 0.45 112.187 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp 57.54 35.97 26.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.582 -0.735 . . . . 2.19 111.131 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -156.5 117.41 3.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.005 -0.543 . . . . 1.11 110.238 -177.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -67.85 -37.42 81.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.766 -0.652 . . . . 1.41 111.367 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.45 -50.31 71.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.469 -0.332 . . . . 2.0 110.817 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.44 -37.37 87.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.084 -0.507 . . . . 1.48 109.957 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.32 -41.59 89.43 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.887 -0.597 . . . . 0.21 110.644 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.405 ' O ' HG23 ' B' ' 220' ' ' VAL . 0.2 OUTLIER -70.77 -42.28 70.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.665 -0.698 . . . . 0.63 110.184 -179.402 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -59.71 -43.07 94.27 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.97 110.67 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.411 HD12 HD21 ' B' ' 209' ' ' LEU . 63.3 mt -72.94 -34.75 66.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.85 -0.614 . . . . 0.2 110.241 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -57.66 -44.28 85.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.06 0.457 . . . . 1.29 110.06 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 216' ' ' ASN . 66.7 t -71.54 -49.45 46.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.749 -0.659 . . . . 0.19 110.277 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 62.9 tp -58.3 -48.7 79.67 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.002 -0.999 . . . . 0.25 110.981 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -65.13 -38.93 92.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.668 -0.696 . . . . 1.24 110.577 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 84.2 tttt -65.56 -34.08 77.42 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.929 -0.309 . . . . 0.35 110.926 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -76.92 -29.33 55.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.09 0.471 . . . . 2.27 110.096 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.47 -42.65 87.19 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.29 -0.633 . . . . 0.16 109.29 173.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.434 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 52.6 t90 -63.62 -37.08 85.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.995 -1.002 . . . . 0.19 110.017 176.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 37.0 mmt180 -62.37 -37.63 86.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 2.25 110.859 175.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.9 t -75.58 -9.95 59.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 1.18 110.788 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 19.4 t -76.46 -7.84 55.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.172 0.51 . . . . 0.93 110.054 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.652 -0.689 . . . . 1.27 109.849 175.893 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.44 ' HB2' ' HB ' ' A' ' 191' ' ' VAL . 9.5 Cg_endo . . . . . 0 N--CA 1.481 0.747 0 N-CA-C 110.703 -0.537 . . . . 1.91 110.703 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 41.1 m 56.46 150.91 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 122.002 0.906 . . . . 2.1 113.43 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . -82.64 53.93 4.87 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.877 -0.678 . . . . 1.67 112.099 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -173.71 -57.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.759 -0.46 . . . . 1.96 109.759 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m -50.86 -50.37 57.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.713 -0.676 . . . . 1.24 112.102 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.448 HG21 ' HG3' ' B' ' 208' ' ' ARG . 11.9 p -70.06 -32.85 52.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 C-N-CA 120.773 -0.371 . . . . 0.35 110.939 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 22.1 t -66.97 -19.85 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.69 0.757 . . . . 0.24 109.749 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.458 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -90.04 12.2 18.41 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.613 -0.721 . . . . 0.24 111.597 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 42.8 p -107.86 152.18 24.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.227 0.536 . . . . 0.26 110.362 -176.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.51 -32.69 74.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.385 -0.825 . . . . 2.46 109.708 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.61 90.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.23 -0.896 . . . . 0.26 111.863 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -62.35 -50.94 69.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.22 110.236 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -69.18 -28.27 66.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.705 -0.679 . . . . 0.17 111.448 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.66 -51.98 65.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 1.23 110.509 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.65 -32.5 65.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.275 -0.42 . . . . 1.37 111.371 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.86 -47.78 83.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.166 -0.679 . . . . 0.18 109.166 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.2 tt0 -67.0 -33.18 75.0 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.925 -0.58 . . . . 0.71 110.195 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.77 -40.12 97.7 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.928 -0.653 . . . . 0.16 111.906 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -67.16 -38.73 85.98 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.528 -0.545 . . . . 1.26 109.528 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.7 mp -66.19 -38.19 87.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.529 -0.76 . . . . 0.19 110.561 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.7 mt-10 -63.36 -48.54 77.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.362 . . . . 1.13 110.863 176.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 95.9 mt-30 -66.24 -40.94 90.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.357 -0.383 . . . . 1.13 112.011 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.467 ' HG3' HG21 ' B' ' 191' ' ' VAL . 5.0 tpt180 -77.75 -48.47 16.57 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 111.814 0.301 . . . . 1.97 111.814 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.1 mp -82.31 -23.34 35.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 0.45 111.784 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 207' ' ' GLN . 33.9 mmtp 58.76 39.82 23.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.274 -0.875 . . . . 2.19 110.487 -174.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -153.1 109.4 3.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.572 -0.74 . . . . 1.12 109.812 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -67.61 -36.43 80.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.279 -0.419 . . . . 1.42 111.497 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -64.05 -50.4 68.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.871 0.367 . . . . 2.01 110.712 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 8.6 tp10 -70.67 -29.86 66.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.095 -0.502 . . . . 1.48 110.29 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.35 85.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.547 0.689 . . . . 0.2 109.752 177.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.2 t-20 -70.1 -46.25 65.25 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.066 -0.97 . . . . 0.63 110.318 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -59.07 -40.72 86.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 1.99 110.899 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.63 -36.89 68.14 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.003 -0.544 . . . . 0.2 110.38 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -58.94 -42.55 90.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.926 0.393 . . . . 1.29 110.388 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 216' ' ' ASN . 88.9 t -71.13 -44.63 74.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.924 -0.58 . . . . 0.19 109.707 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 38.0 tp -57.24 -50.86 71.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.891 -1.049 . . . . 0.26 110.89 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.75 -37.14 81.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.212 -0.904 . . . . 1.25 110.591 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.7 tttt -66.09 -36.38 83.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.36 110.68 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.192 0.52 . . . . 2.28 110.042 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.17 -40.57 86.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.493 -0.776 . . . . 0.16 109.346 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.458 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 47.5 t90 -67.35 -39.81 85.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.063 -0.971 . . . . 0.19 110.366 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.609 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.6 mmm180 -61.32 -39.06 89.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.966 0.412 . . . . 2.25 110.467 176.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.06 -6.21 46.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 1.16 111.131 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 65.8 m -84.52 -9.59 58.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.989 0.423 . . . . 0.93 110.667 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.289 -0.862 . . . . 1.27 110.184 176.074 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . 0.448 ' HB2' ' HB ' ' B' ' 191' ' ' VAL . 9.3 Cg_endo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.514 -0.61 . . . . 1.89 110.514 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 41.4 m 56.49 150.69 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.219 -0.9 . . . . 2.1 113.345 -177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.47 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . -82.27 54.1 4.84 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.897 -0.668 . . . . 1.68 112.166 176.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -173.83 -56.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.693 -0.484 . . . . 1.97 109.693 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 16.3 m -50.85 -50.4 56.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.83 -0.623 . . . . 1.24 111.959 -178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.467 HG21 ' HG3' ' A' ' 208' ' ' ARG . 12.1 p -70.18 -32.95 52.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 C-N-CA 120.961 -0.296 . . . . 0.34 110.883 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 22.4 t -66.95 -19.88 26.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.619 0.723 . . . . 0.23 109.747 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.464 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -90.1 12.37 17.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.613 -0.721 . . . . 0.23 111.432 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.99 152.12 24.9 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.376 0.607 . . . . 0.25 110.355 -176.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.4 -32.65 74.16 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.295 -0.866 . . . . 2.46 109.826 176.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.75 90.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.331 -0.85 . . . . 0.27 111.856 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -62.16 -51.08 69.28 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.22 110.196 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -69.1 -28.13 66.21 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.621 -0.718 . . . . 0.16 111.536 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.64 -51.96 65.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.851 0.358 . . . . 1.25 110.487 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -72.68 -32.52 65.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 1.37 111.386 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.13 -47.58 84.76 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.194 -0.669 . . . . 0.17 109.194 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.0 tt0 -66.99 -33.31 75.3 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.71 110.252 176.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.75 -40.13 97.69 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 121.076 -0.583 . . . . 0.16 112.007 176.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -67.01 -38.73 86.47 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.566 -0.531 . . . . 1.26 109.566 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.6 mp -66.08 -38.38 88.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.433 -0.803 . . . . 0.2 110.528 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.8 mt-10 -63.24 -48.81 76.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.841 0.353 . . . . 1.14 110.801 176.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 95.8 mt-30 -66.09 -40.93 91.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.196 -0.456 . . . . 1.13 111.971 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . 0.448 ' HG3' HG21 ' A' ' 191' ' ' VAL . 5.0 tpt180 -77.8 -48.53 16.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.753 0.311 . . . . 1.98 111.731 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.1 mp -82.38 -23.12 35.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.815 0.302 . . . . 0.45 111.815 -175.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' B' ' 207' ' ' GLN . 33.9 mmtp 58.47 39.8 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.393 -0.822 . . . . 2.19 110.484 -174.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -153.05 109.72 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.507 -0.769 . . . . 1.11 109.736 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -67.55 -36.28 80.66 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.275 -0.421 . . . . 1.41 111.49 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.33 -50.19 68.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.86 0.362 . . . . 2.0 110.804 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 8.3 tp10 -70.78 -29.88 66.2 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.126 -0.488 . . . . 1.48 110.113 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.23 85.63 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.516 0.674 . . . . 0.21 109.641 178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.415 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.3 t-20 -70.22 -46.63 64.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.14 -0.936 . . . . 0.63 110.27 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -58.65 -40.79 84.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 1.97 110.912 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 54.7 mt -72.71 -36.61 67.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.002 -0.544 . . . . 0.2 110.364 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -59.04 -42.63 90.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.898 0.38 . . . . 1.29 110.367 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 216' ' ' ASN . 84.6 t -71.23 -44.6 73.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.42 0.628 . . . . 0.19 109.678 -179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.12 -50.73 71.89 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.945 -1.025 . . . . 0.25 110.915 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 17.6 m-30 -67.99 -37.34 81.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 1.24 110.609 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.608 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.7 tttt -65.87 -36.38 83.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.505 -0.316 . . . . 0.35 110.716 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.21 -31.64 64.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.133 0.492 . . . . 2.27 109.921 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.62 86.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.16 109.341 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.464 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 47.1 t90 -67.49 -39.57 85.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.029 -0.987 . . . . 0.19 110.283 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.2 mmm180 -61.29 -39.34 90.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 2.25 110.423 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -74.31 -5.56 42.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 1.18 111.167 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 59.6 m -84.84 -9.81 57.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.045 0.45 . . . . 0.93 110.64 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.579 -0.724 . . . . 1.27 110.189 175.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo . . . . . 0 N--CA 1.475 0.39 0 N-CA-C 110.613 -0.572 . . . . 1.91 110.613 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 16.7 p -89.0 67.98 8.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.259 -0.428 . . . . 2.1 112.135 -173.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.676 ' O ' HG12 ' A' ' 191' ' ' VAL . . . 80.77 -92.32 1.43 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.858 -0.687 . . . . 1.67 113.139 174.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.67 -35.52 79.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.481 . . . . 1.96 111.061 -174.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 42.4 t -54.74 -37.05 65.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 1.24 111.895 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.676 HG12 ' O ' ' A' ' 188' ' ' GLY . 9.5 p -79.56 -25.8 12.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 C-N-CA 120.231 -0.587 . . . . 0.35 110.034 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.433 HG22 HD11 ' B' ' 209' ' ' LEU . 51.2 t -69.05 -25.0 28.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.411 0.625 . . . . 0.24 109.815 176.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -82.64 12.05 5.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.726 -0.67 . . . . 0.24 111.842 -177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.03 153.01 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.918 0.389 . . . . 0.26 110.487 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.97 -34.77 78.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.866 -0.606 . . . . 2.46 109.747 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.26 -37.67 83.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.453 -0.794 . . . . 0.26 111.829 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . 0.479 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 59.3 t80 -61.9 -51.13 69.41 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.824 0.345 . . . . 0.22 110.099 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . 0.429 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 97.2 m95 -69.02 -28.38 66.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.496 -0.775 . . . . 0.17 111.54 -178.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.17 -49.77 70.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.279 -0.418 . . . . 1.23 110.408 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.01 -33.7 70.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 1.37 110.904 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.405 ' O ' HD13 ' A' ' 205' ' ' LEU . 1.7 tm? -59.49 -47.63 84.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.378 -0.601 . . . . 0.18 109.378 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 57.5 tt0 -66.47 -33.47 75.76 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.089 -0.505 . . . . 0.71 110.272 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -60.8 -41.28 99.08 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 121.049 -0.596 . . . . 0.16 111.929 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -66.95 -38.4 86.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 1.26 109.784 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.8 mp -65.22 -37.76 88.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.582 -0.735 . . . . 0.19 110.475 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 49.7 mt-10 -65.9 -45.41 82.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.567 -0.288 . . . . 1.13 110.828 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.0 mt-30 -61.97 -48.29 81.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.931 0.396 . . . . 1.13 111.459 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -72.75 -48.31 39.57 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.941 -0.572 . . . . 1.97 111.383 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.455 HD11 HG22 ' B' ' 192' ' ' VAL . 6.6 mp -83.13 -23.12 33.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.079 -0.509 . . . . 0.45 111.352 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 45.4 tptt 55.56 39.97 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.222 -0.899 . . . . 2.19 109.928 -174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.85 113.75 3.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.624 -0.716 . . . . 1.12 110.434 -176.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -67.87 -33.85 75.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.853 -0.612 . . . . 1.42 111.244 -177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -65.67 -51.11 61.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.449 . . . . 2.01 111.026 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -68.82 -35.09 76.56 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 1.48 109.988 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.82 -39.34 87.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.738 -0.664 . . . . 0.2 110.486 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.1 t-20 -66.98 -48.31 68.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.57 -0.741 . . . . 0.63 110.311 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.99 -39.22 77.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.88 -0.6 . . . . 1.99 111.027 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 42.7 mt -72.66 -39.43 67.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.138 -0.483 . . . . 0.2 110.9 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.26 -41.02 87.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.059 0.457 . . . . 1.29 110.179 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.464 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 87.3 t -70.24 -44.69 77.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.689 -0.687 . . . . 0.19 109.66 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.0 -49.89 76.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.98 -1.009 . . . . 0.26 110.624 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -68.1 -38.56 82.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.329 -0.85 . . . . 1.25 110.852 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.8 tttt -67.11 -36.16 81.34 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.823 -0.351 . . . . 0.36 110.821 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 47.3 mm-40 -75.38 -28.9 59.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.04 0.447 . . . . 2.28 110.024 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.2 -40.04 82.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.65 -0.705 . . . . 0.16 109.301 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 51.5 t90 -64.7 -40.21 94.98 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.917 -1.038 . . . . 0.19 109.851 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.8 mmm180 -62.97 -39.99 96.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.997 -0.547 . . . . 2.25 110.661 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 25.9 t -73.48 -6.1 44.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 1.16 111.116 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 21.0 t -79.28 -13.56 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.154 0.502 . . . . 0.93 109.756 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.576 -0.726 . . . . 1.27 110.01 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.475 0.425 0 N-CA-C 110.71 -0.535 . . . . 1.89 110.71 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 14.7 p -88.85 68.42 8.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.024 0.44 . . . . 2.1 112.034 -173.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.681 ' O ' HG12 ' B' ' 191' ' ' VAL . . . 80.56 -92.18 1.41 Allowed Glycine 0 C--O 1.226 -0.389 0 C-N-CA 120.986 -0.626 . . . . 1.68 113.237 174.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -62.66 -35.7 80.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.064 0.459 . . . . 1.97 111.158 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 43.9 t -54.52 -37.17 65.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.879 -0.6 . . . . 1.24 111.931 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.681 HG12 ' O ' ' B' ' 188' ' ' GLY . 9.4 p -79.58 -25.71 12.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 120.262 -0.575 . . . . 0.34 109.96 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.455 HG22 HD11 ' A' ' 209' ' ' LEU . 51.5 t -69.09 -25.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.423 0.63 . . . . 0.23 109.8 176.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -82.38 11.82 5.12 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.763 -0.653 . . . . 0.23 111.949 -177.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 51.4 p -107.01 153.07 23.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.967 0.413 . . . . 0.25 110.49 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.0 -34.59 78.45 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.756 -0.656 . . . . 2.46 109.823 176.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.79 84.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.343 -0.844 . . . . 0.27 111.828 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -61.81 -51.14 69.49 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.22 110.134 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . 0.437 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 97.2 m95 -69.17 -28.31 66.29 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.511 -0.768 . . . . 0.16 111.453 -178.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.11 -49.8 70.79 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.232 -0.44 . . . . 1.25 110.473 174.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.12 -33.75 70.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 1.37 110.864 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . 0.41 ' O ' HD13 ' B' ' 205' ' ' LEU . 1.8 tm? -59.23 -47.88 83.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.326 -0.62 . . . . 0.17 109.326 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.423 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 57.4 tt0 -66.25 -33.63 76.18 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.969 -0.56 . . . . 0.71 110.349 176.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.67 -41.07 98.79 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.057 -0.592 . . . . 0.16 111.873 176.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -67.32 -38.37 84.82 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.668 -0.493 . . . . 1.26 109.668 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.9 mp -65.13 -37.69 88.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.755 . . . . 0.2 110.55 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 49.3 mt-10 -65.77 -45.82 81.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.589 -0.278 . . . . 1.14 110.873 177.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 52.9 mt-30 -61.74 -48.27 81.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 1.13 111.375 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' B' ' 208' ' ' ARG . 4.4 tpt180 -72.66 -48.18 41.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.81 -0.632 . . . . 1.98 111.482 -173.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.6 mp -83.43 -23.02 32.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.05 -0.523 . . . . 0.45 111.496 -176.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' B' ' 210' ' ' LYS . 45.4 tptt 55.67 39.62 30.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.254 -0.885 . . . . 2.19 109.928 -175.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.79 113.52 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.594 -0.73 . . . . 1.11 110.32 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -67.84 -33.71 75.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.792 -0.64 . . . . 1.41 111.22 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.8 -51.09 61.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.233 -0.44 . . . . 2.0 110.91 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.95 -35.09 76.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.858 -0.61 . . . . 1.48 109.957 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.31 87.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.759 -0.655 . . . . 0.21 110.45 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.446 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.3 t-20 -66.93 -48.46 68.55 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.56 -0.745 . . . . 0.63 110.382 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -57.97 -39.04 77.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.917 -0.583 . . . . 1.97 111.011 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.413 HD11 HG21 ' A' ' 192' ' ' VAL . 42.6 mt -72.82 -39.46 66.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.207 -0.451 . . . . 0.2 110.916 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -59.17 -41.15 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 1.29 110.236 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 90.1 t -70.24 -44.66 77.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.684 -0.689 . . . . 0.19 109.647 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 61.0 tp -59.06 -49.61 77.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.869 -1.059 . . . . 0.25 110.683 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -68.33 -38.35 81.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.428 -0.805 . . . . 1.24 110.869 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.9 tttt -67.2 -36.23 81.3 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.837 -0.345 . . . . 0.35 110.89 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 49.7 mm-40 -75.34 -28.74 59.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 2.27 110.056 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.94 81.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.639 -0.71 . . . . 0.16 109.313 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 51.3 t90 -64.8 -40.05 94.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.846 -1.07 . . . . 0.19 109.854 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.7 mmm180 -63.12 -40.08 96.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.867 -0.606 . . . . 2.25 110.693 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.6 t -73.38 -5.84 42.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.858 0.361 . . . . 1.18 111.108 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 20.9 t -79.35 -13.71 59.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.157 0.503 . . . . 0.93 109.847 178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.245 0.832 0 CA-C-O 118.58 -0.724 . . . . 1.27 110.142 177.513 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 N--CA 1.478 0.562 0 N-CA-C 110.274 -0.702 . . . . 1.91 110.274 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 33.2 t -158.19 66.06 0.46 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.039 0.447 . . . . 2.1 110.802 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 54.86 37.23 61.59 Favored Glycine 0 C--O 1.225 -0.451 0 N-CA-C 115.027 0.771 . . . . 1.67 115.027 175.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -174.89 -48.84 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.427 0.632 . . . . 1.96 109.908 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 2.5 p -59.85 -29.3 68.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.155 -0.93 . . . . 1.24 110.818 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 197' ' ' PHE . 14.4 p -76.36 -30.36 19.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 116.236 -0.438 . . . . 0.35 110.185 175.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.442 HG22 HD11 ' B' ' 209' ' ' LEU . 60.7 t -69.7 -23.68 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.545 0.688 . . . . 0.24 109.614 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.24 12.43 5.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.477 -0.783 . . . . 0.24 111.505 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.0 p -107.82 150.23 27.27 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.076 0.465 . . . . 0.26 110.494 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.41 -34.14 77.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.417 -0.811 . . . . 2.46 109.844 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.0 -35.33 78.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.165 -0.925 . . . . 0.26 111.809 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 191' ' ' VAL . 58.9 t80 -63.87 -51.04 66.4 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.865 0.364 . . . . 0.22 110.123 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 93.9 m95 -68.11 -29.89 68.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.721 -0.672 . . . . 0.17 111.255 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.9 -43.92 78.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.432 -0.349 . . . . 1.23 110.338 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -71.7 -35.85 70.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.212 0.53 . . . . 1.37 109.75 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.65 -47.73 83.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.426 -0.806 . . . . 0.18 109.348 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.507 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 49.7 tt0 -67.62 -28.68 67.95 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.196 -0.457 . . . . 0.71 110.204 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.27 -41.77 98.46 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.854 -0.689 . . . . 0.16 111.599 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -66.81 -38.24 86.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 1.26 109.87 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.1 mp -66.5 -40.03 89.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.754 -0.657 . . . . 0.19 110.698 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.13 -43.61 91.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.568 0.223 . . . . 1.13 110.939 177.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.429 ' O ' ' HE2' ' A' ' 210' ' ' LYS . 49.4 mt-30 -60.8 -48.94 79.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.823 0.344 . . . . 1.13 111.707 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.24 -43.49 51.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.153 -0.476 . . . . 1.97 111.55 -173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.459 HD11 HG22 ' B' ' 192' ' ' VAL . 7.9 mp -88.28 -23.71 23.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.218 -0.446 . . . . 0.45 112.202 -174.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.429 ' HE2' ' O ' ' A' ' 207' ' ' GLN . 75.5 mmtt 55.09 38.61 30.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.868 -0.605 . . . . 2.19 110.679 -175.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -150.03 110.68 4.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 1.12 109.351 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -65.29 -38.98 91.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.133 -0.485 . . . . 1.42 111.46 -175.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.37 -50.42 69.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.264 -0.425 . . . . 2.01 111.02 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 5.0 tp10 -69.23 -35.1 75.8 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.002 0.43 . . . . 1.48 110.461 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.47 89.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.359 0.6 . . . . 0.2 110.203 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 2.7 t-20 -70.19 -45.38 66.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.164 -0.925 . . . . 0.63 109.904 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -58.0 -40.44 80.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.645 -0.707 . . . . 1.99 111.134 177.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.401 ' HB2' HD23 ' A' ' 205' ' ' LEU . 56.7 mt -72.47 -37.51 68.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.16 -0.473 . . . . 0.2 110.455 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . 0.507 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 48.4 ttp180 -56.36 -41.44 76.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.103 0.478 . . . . 1.29 110.155 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.612 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 89.2 t -70.57 -49.1 54.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.509 -0.768 . . . . 0.19 109.901 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 62.6 tp -57.76 -48.74 78.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.867 -1.061 . . . . 0.26 110.829 -177.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -66.27 -38.32 87.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.61 -0.723 . . . . 1.25 110.524 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 86.2 tttt -64.4 -36.9 85.67 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.36 110.81 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 51.9 mt-10 -73.96 -30.59 62.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 2.28 109.735 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.5 -43.51 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.658 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -64.69 -39.96 94.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.237 -0.892 . . . . 0.19 110.08 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 24.8 mmm180 -63.21 -39.23 94.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.971 -0.559 . . . . 2.25 111.088 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 22.0 m -73.98 -5.01 38.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.499 -0.319 . . . . 1.16 111.446 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 27.4 t -79.66 -11.53 59.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.281 0.562 . . . . 0.93 109.749 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.435 -0.793 . . . . 1.27 110.205 178.231 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo . . . . . 0 N--CA 1.479 0.662 0 N-CA-C 110.184 -0.737 . . . . 1.89 110.184 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 34.2 t -157.73 65.76 0.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.065 0.459 . . . . 2.1 110.674 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 55.37 37.13 64.82 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 114.939 0.736 . . . . 1.68 114.939 175.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -174.99 -48.7 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 117.447 0.624 . . . . 1.97 109.872 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 2.7 p -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.32 -0.855 . . . . 1.24 110.746 177.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' B' ' 197' ' ' PHE . 14.5 p -76.12 -30.16 20.15 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.372 -0.376 . . . . 0.34 110.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.459 HG22 HD11 ' A' ' 209' ' ' LEU . 60.5 t -69.82 -23.45 25.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.541 0.686 . . . . 0.23 109.585 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -83.51 12.25 5.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.543 -0.753 . . . . 0.23 111.516 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 42.1 p -107.58 150.18 27.16 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.191 0.519 . . . . 0.25 110.446 -176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -65.41 -34.21 77.76 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.358 -0.837 . . . . 2.46 109.777 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.29 78.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.267 -0.878 . . . . 0.27 111.798 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' B' ' 191' ' ' VAL . 59.1 t80 -63.79 -50.86 67.33 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 120.914 0.388 . . . . 0.22 110.207 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . 0.471 ' CH2' ' HA ' ' B' ' 223' ' ' LYS . 94.0 m95 -68.39 -29.86 68.65 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.756 -0.657 . . . . 0.16 111.238 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -67.81 -43.6 79.26 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.836 0.35 . . . . 1.25 110.557 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -72.0 -35.76 69.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.326 0.584 . . . . 1.37 109.84 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -58.7 -47.71 83.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.17 109.31 175.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 49.7 tt0 -67.61 -28.81 68.06 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 116.157 -0.474 . . . . 0.71 110.24 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -60.21 -41.63 98.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.793 -0.718 . . . . 0.16 111.623 174.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -66.9 -38.07 85.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.004 0.43 . . . . 1.26 109.856 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.2 mp -66.77 -40.01 88.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.724 -0.671 . . . . 0.2 110.623 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.96 -43.73 91.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.805 -0.18 . . . . 1.14 110.896 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.431 ' O ' ' HE2' ' B' ' 210' ' ' LYS . 49.2 mt-30 -61.25 -48.08 83.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 1.13 111.882 177.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -75.62 -43.64 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.21 -0.45 . . . . 1.98 111.476 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.442 HD11 HG22 ' A' ' 192' ' ' VAL . 8.1 mp -88.2 -23.88 23.45 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.065 -0.516 . . . . 0.45 112.085 -174.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' B' ' 207' ' ' GLN . 75.4 mmtt 55.4 38.31 30.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.753 -0.658 . . . . 2.19 110.689 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -149.64 110.76 4.38 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.701 -0.682 . . . . 1.11 109.476 -176.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -64.98 -39.13 93.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.091 -0.504 . . . . 1.41 111.611 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -63.33 -50.5 69.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.388 -0.369 . . . . 2.0 111.089 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 4.9 tp10 -69.3 -35.1 75.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 1.48 110.362 -176.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.04 -39.56 90.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.21 110.209 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.443 ' O ' HG23 ' B' ' 220' ' ' VAL . 2.7 t-20 -70.26 -45.37 66.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.181 -0.918 . . . . 0.63 109.929 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -58.0 -40.48 80.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.97 111.059 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.404 ' HB2' HD23 ' B' ' 205' ' ' LEU . 57.9 mt -72.4 -37.54 68.65 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.165 -0.47 . . . . 0.2 110.519 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 48.3 ttp180 -56.43 -41.33 76.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 1.29 110.221 175.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.595 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 93.5 t -70.57 -49.11 54.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.548 -0.751 . . . . 0.19 109.866 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.07 -48.6 79.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.849 -1.069 . . . . 0.25 110.793 -177.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -66.23 -38.22 87.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.632 -0.713 . . . . 1.24 110.552 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.1 tttt -64.59 -36.73 85.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.835 -0.346 . . . . 0.35 110.783 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 54.1 mt-10 -74.13 -30.57 62.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.611 -0.514 . . . . 2.27 109.611 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -66.46 -43.72 84.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.621 -0.718 . . . . 0.16 109.67 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . . . . . . . . . 57.2 t90 -64.64 -39.76 94.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.323 -0.853 . . . . 0.19 110.096 177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 24.9 mmm180 -63.58 -39.13 93.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 2.25 110.985 177.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 22.2 m -74.07 -4.57 36.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.556 -0.293 . . . . 1.18 111.353 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 25.1 t -79.89 -11.78 59.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.93 109.78 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.49 -0.767 . . . . 1.27 110.134 178.185 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 N--CA 1.477 0.554 0 N-CA-C 110.021 -0.8 . . . . 1.91 110.021 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.8 t -133.76 69.1 1.47 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.173 0.511 . . . . 2.1 110.599 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.423 ' O ' HG12 ' A' ' 191' ' ' VAL . . . 117.25 -116.87 3.63 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.624 -0.798 . . . . 1.67 113.524 176.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.97 -40.77 90.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.053 0.76 . . . . 1.96 113.053 -169.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 23.2 t -50.51 -41.85 54.14 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.618 0.599 . . . . 1.24 112.618 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 188' ' ' GLY . 10.5 p -79.65 -28.03 12.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.321 -0.552 . . . . 0.35 110.491 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.468 HG22 HD11 ' B' ' 209' ' ' LEU . 40.7 t -68.5 -23.26 27.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.506 0.67 . . . . 0.24 109.912 177.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.447 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -83.61 12.28 6.0 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.725 -0.671 . . . . 0.24 111.658 -178.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 48.4 p -106.9 145.67 31.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.246 0.546 . . . . 0.26 110.108 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.13 -32.15 73.7 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.38 -0.827 . . . . 2.46 109.776 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.63 -36.47 82.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.736 -0.665 . . . . 0.26 111.564 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -61.8 -50.9 70.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.016 0.436 . . . . 0.22 109.959 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -69.07 -28.58 66.66 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.17 111.463 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.56 -49.39 71.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 1.23 110.281 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -72.68 -33.58 66.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.247 -0.433 . . . . 1.37 111.137 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.96 -47.53 84.78 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.229 -0.656 . . . . 0.18 109.229 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' A' ' 206' ' ' GLU . 55.7 tt0 -65.94 -35.54 80.89 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.954 -0.566 . . . . 0.71 110.302 175.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -58.74 -41.96 96.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.033 -0.603 . . . . 0.16 112.017 177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -67.44 -38.12 84.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.456 -0.572 . . . . 1.26 109.456 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.5 mp -65.91 -35.44 80.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.394 -0.821 . . . . 0.19 110.68 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 202' ' ' GLN . 44.9 mt-10 -64.53 -48.89 73.42 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.94 0.4 . . . . 1.13 110.48 177.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 48.4 mt-30 -65.44 -41.83 93.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.908 -0.587 . . . . 1.13 111.622 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.64 -50.78 16.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.176 -0.465 . . . . 1.97 111.447 -177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 8.0 mp -78.16 -22.11 49.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.45 112.071 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.57 16.12 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.899 0.749 . . . . 2.19 110.464 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.4 118.97 3.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.237 -0.438 . . . . 1.12 110.384 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -68.7 -37.78 79.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.771 -0.649 . . . . 1.42 111.609 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.82 -49.66 71.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.401 -0.363 . . . . 2.01 111.096 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.62 -31.09 70.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.198 0.523 . . . . 1.48 110.04 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.26 84.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 0.2 110.029 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 3.8 t-20 -69.2 -44.51 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.516 -0.765 . . . . 0.63 109.978 177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.18 -41.51 84.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.851 -0.613 . . . . 1.99 110.887 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.471 HD11 HG21 ' B' ' 192' ' ' VAL . 40.8 mt -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.105 -0.498 . . . . 0.2 110.731 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -59.96 -43.67 94.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.023 0.44 . . . . 1.29 110.184 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.616 ' O ' ' HG2' ' A' ' 224' ' ' GLU . 64.5 t -70.48 -46.7 69.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.694 -0.685 . . . . 0.19 109.546 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 65.6 tp -58.19 -49.07 78.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.02 -0.991 . . . . 0.26 110.728 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -67.72 -36.82 81.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.508 -0.769 . . . . 1.25 110.579 -178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.508 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.3 tttt -68.42 -33.86 74.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.638 0.256 . . . . 0.36 110.96 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 220' ' ' VAL . 51.1 mm-40 -75.4 -29.25 59.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.326 0.584 . . . . 2.28 109.723 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' B' ' 225' ' ' ALA . . . -67.98 -40.31 83.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.384 -0.825 . . . . 0.16 109.2 174.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.447 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -65.52 -38.59 90.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.957 -1.02 . . . . 0.19 109.892 177.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 40.4 mmt180 -58.98 -41.13 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 2.25 110.383 173.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 17.6 m -73.85 -10.0 59.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 1.16 111.49 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 15.9 t -74.59 -13.77 60.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.871 0.367 . . . . 0.93 110.613 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.655 -0.688 . . . . 1.27 110.154 178.593 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.477 0.504 0 N-CA-C 109.974 -0.818 . . . . 1.89 109.974 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 24.0 t -133.9 69.24 1.47 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.154 0.502 . . . . 2.1 110.689 -177.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.418 ' O ' HG12 ' B' ' 191' ' ' VAL . . . 117.54 -117.05 3.66 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.636 -0.792 . . . . 1.68 113.603 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -59.97 -40.68 89.91 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.127 0.788 . . . . 1.97 113.127 -169.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 22.9 t -50.48 -41.76 53.62 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.502 0.556 . . . . 1.24 112.502 -175.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.418 HG12 ' O ' ' B' ' 188' ' ' GLY . 10.5 p -80.1 -27.82 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.388 -0.525 . . . . 0.34 110.536 -178.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 218' ' ' LEU . 40.5 t -68.48 -23.39 28.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.502 0.668 . . . . 0.23 110.003 177.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.459 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -83.51 11.96 6.32 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.596 -0.729 . . . . 0.23 111.555 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 47.5 p -106.34 145.79 31.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.168 0.508 . . . . 0.25 110.199 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.2 -32.15 73.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.457 -0.792 . . . . 2.46 109.751 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.23 82.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.682 -0.69 . . . . 0.27 111.625 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.91 -50.94 70.15 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.848 -0.427 . . . . 0.22 109.848 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -68.95 -28.79 66.96 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.39 -0.823 . . . . 0.16 111.557 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.48 -49.53 71.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.321 -0.4 . . . . 1.25 110.229 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.48 -33.63 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 1.37 111.189 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.95 -47.54 84.71 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.228 -0.656 . . . . 0.17 109.228 175.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.471 ' O ' ' HG3' ' B' ' 206' ' ' GLU . 55.8 tt0 -65.91 -35.24 80.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.018 -0.537 . . . . 0.71 110.324 175.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -59.02 -42.01 96.73 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.046 -0.597 . . . . 0.16 112.168 177.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -67.35 -38.1 84.29 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.574 -0.528 . . . . 1.26 109.574 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.5 mp -65.94 -35.48 80.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.493 -0.776 . . . . 0.2 110.624 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' B' ' 202' ' ' GLN . 44.6 mt-10 -64.66 -48.68 73.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.794 0.33 . . . . 1.14 110.423 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 48.7 mt-30 -65.72 -41.65 92.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 1.13 111.564 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -74.59 -50.8 16.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.088 -0.505 . . . . 1.98 111.431 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 8.0 mp -78.27 -22.19 48.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.45 112.089 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp 62.69 32.64 16.09 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.907 0.755 . . . . 2.19 110.549 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -157.33 119.02 3.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 1.11 110.393 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -68.65 -37.64 79.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.831 -0.622 . . . . 1.41 111.557 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.0 -49.63 71.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.839 0.352 . . . . 2.0 111.035 -175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -68.83 -30.82 69.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.957 -0.565 . . . . 1.48 110.045 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.15 84.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.765 -0.652 . . . . 0.21 110.092 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.457 ' O ' HG23 ' B' ' 220' ' ' VAL . 3.9 t-20 -69.17 -44.59 71.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.499 -0.773 . . . . 0.63 109.985 177.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -58.15 -41.31 83.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 1.97 111.001 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.465 HD12 HD21 ' B' ' 209' ' ' LEU . 40.1 mt -73.21 -36.62 66.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.063 -0.517 . . . . 0.2 110.682 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -60.0 -43.4 95.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.992 0.425 . . . . 1.29 110.218 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.6 ' O ' ' HG2' ' B' ' 224' ' ' GLU . 62.0 t -70.6 -46.95 67.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 0.19 109.539 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 65.7 tp -58.0 -48.87 78.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.924 -1.035 . . . . 0.25 110.855 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -67.82 -37.07 81.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.467 -0.788 . . . . 1.24 110.554 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 85.5 tttt -68.19 -34.24 75.93 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 121.068 -0.253 . . . . 0.35 110.936 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' B' ' 220' ' ' VAL . 52.3 mm-40 -75.25 -29.27 60.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.467 0.651 . . . . 2.27 109.675 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 225' ' ' ALA . . . -67.94 -40.34 83.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.511 -0.768 . . . . 0.16 109.232 174.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.459 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.5 t90 -65.39 -38.58 90.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.019 -0.992 . . . . 0.19 109.933 177.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 40.5 mmt180 -58.99 -41.06 86.71 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 2.25 110.372 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 16.5 m -73.73 -10.12 59.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.077 -0.51 . . . . 1.18 111.501 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 16.8 t -74.75 -13.65 60.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.975 0.417 . . . . 0.93 110.512 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.687 -0.673 . . . . 1.27 110.358 178.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 N--CA 1.479 0.629 0 N-CA-C 110.635 -0.563 . . . . 1.91 110.635 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 51.1 m -114.66 53.29 0.81 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.397 0.618 . . . . 2.1 110.7 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.511 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 69.09 63.96 3.21 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.303 -0.862 . . . . 1.67 113.889 176.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -165.22 -65.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 117.098 0.449 . . . . 1.96 111.025 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 12.8 m -56.41 -45.73 80.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 1.24 111.096 -175.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 CA-C-N 116.359 -0.382 . . . . 0.35 110.856 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.408 HG13 ' CE2' ' A' ' 197' ' ' PHE . 19.4 t -69.22 -20.16 24.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.457 0.646 . . . . 0.24 110.018 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.411 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -89.0 11.63 17.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.898 -0.592 . . . . 0.24 111.458 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 49.1 p -106.51 158.56 16.83 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.601 -0.44 . . . . 0.26 110.764 -175.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.04 -39.14 89.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.863 -0.608 . . . . 2.46 109.615 175.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.97 -38.45 76.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.131 -0.94 . . . . 0.26 112.292 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . 0.408 ' CE2' HG13 ' A' ' 192' ' ' VAL . 76.4 t80 -63.25 -51.31 66.71 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.749 -0.381 . . . . 0.22 110.348 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . 0.401 ' CH2' ' HA ' ' A' ' 223' ' ' LYS . 95.4 m95 -70.09 -29.13 66.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.803 -0.635 . . . . 0.17 111.505 -178.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -64.14 -52.02 61.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.135 -0.484 . . . . 1.23 110.413 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -71.61 -32.39 67.96 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 1.37 111.09 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.72 -46.75 86.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.171 -0.677 . . . . 0.18 109.171 175.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.27 -37.31 86.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.71 110.601 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 207' ' ' GLN . . . -59.7 -39.52 95.35 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.938 -0.649 . . . . 0.16 112.142 176.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -66.14 -40.25 90.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.473 0.654 . . . . 1.26 109.294 177.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 3.9 mp -64.53 -34.28 77.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.07 -0.968 . . . . 0.19 110.487 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.66 -45.93 84.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.738 0.304 . . . . 1.13 110.419 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 203' ' ' GLY . 52.6 mt-30 -58.93 -47.54 84.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 1.13 111.831 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.63 -45.41 17.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.236 -0.438 . . . . 1.97 112.136 -174.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.8 mp -82.16 -23.01 35.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.45 112.004 -172.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 56.81 37.24 28.67 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 123.969 0.793 . . . . 2.19 110.427 -176.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -156.47 110.3 2.71 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.566 -0.743 . . . . 1.12 109.8 -177.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.78 -34.16 76.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.087 -0.506 . . . . 1.42 111.222 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.27 -50.83 64.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.417 -0.356 . . . . 2.01 111.25 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.75 -27.95 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.985 0.422 . . . . 1.48 110.02 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.49 -37.21 84.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.493 0.663 . . . . 0.2 109.526 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.439 ' O ' HG23 ' A' ' 220' ' ' VAL . 2.8 t-20 -70.21 -46.63 64.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.274 -0.876 . . . . 0.63 110.121 178.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -58.27 -39.7 79.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.729 -0.669 . . . . 1.99 111.077 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.544 HD12 HD21 ' A' ' 209' ' ' LEU . 33.5 mt -73.67 -36.29 65.31 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.183 -0.462 . . . . 0.2 110.653 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -57.66 -43.62 85.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.171 0.51 . . . . 1.29 110.007 177.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 58.8 t -71.38 -49.29 48.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.401 -0.818 . . . . 0.19 109.764 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.501 HD21 ' O ' ' B' ' 225' ' ' ALA . 56.6 tp -57.14 -48.2 79.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.867 -1.06 . . . . 0.26 110.994 -177.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.39 -37.42 86.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.598 -0.728 . . . . 1.25 110.409 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 227' ' ' ARG . 85.9 tttt -66.25 -33.64 76.21 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.836 -0.346 . . . . 0.36 110.726 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.71 64.7 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.521 -0.548 . . . . 2.28 109.521 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . 0.467 ' O ' HD21 ' B' ' 221' ' ' LEU . . . -68.29 -42.17 79.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.374 -0.83 . . . . 0.16 109.672 176.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.411 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 43.6 t90 -63.69 -39.03 93.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.276 -0.875 . . . . 0.19 110.131 177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 223' ' ' LYS . 28.6 mmm180 -64.12 -34.4 77.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.312 -0.403 . . . . 2.25 110.351 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 23.3 t -77.37 -7.35 55.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.526 -0.306 . . . . 1.16 111.032 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 32.4 t -75.21 -17.16 60.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.53 0.681 . . . . 0.93 109.563 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.413 -0.803 . . . . 1.27 109.684 176.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.477 0.516 0 N-CA-C 110.483 -0.622 . . . . 1.89 110.483 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 50.1 m -114.51 52.88 0.82 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.484 0.659 . . . . 2.1 110.816 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.496 ' HA2' ' HG ' ' A' ' 209' ' ' LEU . . . 69.28 63.77 3.27 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.197 -0.911 . . . . 1.68 113.874 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -164.99 -65.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.084 0.442 . . . . 1.97 111.111 177.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 11.4 m -56.8 -45.5 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.06 -0.518 . . . . 1.24 111.146 -175.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.64 -36.37 77.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.368 -0.378 . . . . 0.34 110.816 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.414 HG22 HD11 ' A' ' 209' ' ' LEU . 19.2 t -68.98 -20.37 24.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.529 0.68 . . . . 0.23 110.002 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.42 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -89.05 11.54 18.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.876 -0.602 . . . . 0.23 111.52 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 50.1 p -106.52 158.65 16.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.93 0.395 . . . . 0.25 110.577 -175.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -65.97 -39.27 90.24 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.497 -0.557 . . . . 2.46 109.497 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -57.86 -38.65 76.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.157 -0.928 . . . . 0.27 112.36 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . 0.402 ' CE2' HG13 ' B' ' 192' ' ' VAL . 75.7 t80 -63.33 -51.2 66.97 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.714 -0.394 . . . . 0.22 110.332 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -70.09 -29.07 65.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.926 -0.579 . . . . 0.16 111.502 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.21 -52.11 60.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.458 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -71.66 -32.28 67.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.138 -0.483 . . . . 1.37 111.018 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.7 -46.69 86.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.255 -0.646 . . . . 0.17 109.255 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -65.26 -37.19 86.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.856 -0.611 . . . . 0.71 110.618 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . 0.451 ' O ' ' HG3' ' B' ' 207' ' ' GLN . . . -60.0 -39.1 95.21 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.994 -0.622 . . . . 0.16 112.163 176.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -66.4 -40.26 89.52 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.535 0.683 . . . . 1.26 109.4 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 3.8 mp -64.68 -34.27 77.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.106 -0.952 . . . . 0.2 110.516 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.49 -46.24 83.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.772 0.32 . . . . 1.14 110.271 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' B' ' 203' ' ' GLY . 53.4 mt-30 -58.9 -47.37 85.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.554 . . . . 1.13 111.8 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -80.77 -45.4 17.06 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.163 0.431 . . . . 1.98 112.163 -174.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.7 mp -82.14 -22.97 35.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.259 -0.428 . . . . 0.45 112.045 -172.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.78 37.45 28.81 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.987 0.804 . . . . 2.19 110.398 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -156.71 109.92 2.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.472 -0.786 . . . . 1.11 109.845 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -67.53 -34.23 76.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.012 -0.54 . . . . 1.41 111.285 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.22 -50.93 63.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.51 -0.314 . . . . 2.0 111.098 -176.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -70.81 -27.76 64.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.019 0.438 . . . . 1.48 110.049 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -66.56 -37.26 84.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.583 0.706 . . . . 0.21 109.594 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.447 ' O ' HG23 ' B' ' 220' ' ' VAL . 2.9 t-20 -70.08 -46.86 64.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.185 -0.916 . . . . 0.63 110.124 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -57.85 -40.15 79.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.714 -0.676 . . . . 1.97 111.116 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.527 HD12 HD21 ' B' ' 209' ' ' LEU . 32.9 mt -73.4 -36.3 66.0 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.179 -0.464 . . . . 0.2 110.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -57.73 -43.49 85.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.152 0.501 . . . . 1.29 110.06 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.579 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 60.5 t -71.43 -49.33 47.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.457 -0.792 . . . . 0.19 109.798 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 225' ' ' ALA . 56.7 tp -56.98 -48.16 79.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.968 -1.014 . . . . 0.25 111.061 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.5 -37.56 87.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.581 -0.736 . . . . 1.24 110.235 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . 0.538 ' O ' ' HG2' ' B' ' 227' ' ' ARG . 86.0 tttt -65.99 -33.84 76.72 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.86 -0.336 . . . . 0.35 110.707 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.579 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 39.3 mt-10 -73.35 -32.63 64.65 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.556 -0.535 . . . . 2.27 109.556 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . 0.501 ' O ' HD21 ' A' ' 221' ' ' LEU . . . -68.38 -42.19 79.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.394 -0.821 . . . . 0.16 109.602 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.42 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 43.8 t90 -63.68 -38.93 92.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.285 -0.87 . . . . 0.19 110.249 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' B' ' 223' ' ' LYS . 28.5 mmm180 -64.24 -34.43 78.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.232 -0.44 . . . . 2.25 110.397 176.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 23.1 t -77.48 -6.86 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.444 -0.344 . . . . 1.18 111.147 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 31.6 t -75.52 -16.9 60.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.452 -0.573 . . . . 0.93 109.452 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.419 -0.801 . . . . 1.27 109.966 176.98 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo . . . . . 0 N--CA 1.48 0.694 0 N-CA-C 110.411 -0.65 . . . . 1.91 110.411 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 22.2 m -127.88 61.12 1.43 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.298 0.571 . . . . 2.1 110.341 177.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.459 ' HA2' ' HG ' ' B' ' 209' ' ' LEU . . . 65.48 62.07 5.14 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.412 -0.813 . . . . 1.67 114.377 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -164.29 -72.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 117.152 0.476 . . . . 1.96 110.96 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 26.4 t -51.23 -47.62 62.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.408 -0.36 . . . . 1.24 111.637 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.6 p -68.6 -33.16 58.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.553 0.216 . . . . 0.35 111.122 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.439 HG13 ' CE2' ' A' ' 197' ' ' PHE . 44.0 t -69.14 -22.55 26.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.405 0.622 . . . . 0.24 110.183 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . . . . . . . . . . . -86.16 12.36 9.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.837 -0.62 . . . . 0.24 111.756 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 36.9 p -108.43 155.32 20.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.013 0.435 . . . . 0.26 110.844 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -65.37 -32.97 74.89 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.75 -0.659 . . . . 2.46 109.262 174.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -59.01 -41.88 88.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.035 -0.984 . . . . 0.26 111.982 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . 0.446 ' CE1' HD11 ' B' ' 209' ' ' LEU . 54.2 t80 -64.3 -50.35 68.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.726 -0.39 . . . . 0.22 110.557 -179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.1 -28.5 66.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.071 -0.513 . . . . 0.17 110.97 -177.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -63.74 -49.7 72.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.998 -0.547 . . . . 1.23 110.433 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -70.94 -34.09 71.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.207 -0.452 . . . . 1.37 110.929 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 205' ' ' LEU . 2.9 tm? -60.21 -48.04 83.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.957 -0.565 . . . . 0.18 109.739 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.442 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 47.1 tt0 -68.8 -34.7 75.96 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.677 -0.409 . . . . 0.71 110.364 176.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.09 95.41 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.78 -0.724 . . . . 0.16 111.773 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -67.62 -38.39 83.83 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.702 -0.481 . . . . 1.26 109.702 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 4.9 mp -66.03 -37.35 85.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.832 -0.622 . . . . 0.19 110.608 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -64.09 -47.36 80.35 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.713 0.292 . . . . 1.13 110.552 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -66.85 -43.23 84.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.177 -0.465 . . . . 1.13 111.77 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 8.7 tpt85 -75.15 -48.44 23.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.915 0.388 . . . . 1.97 111.308 -175.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -77.24 -22.07 52.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.912 -0.585 . . . . 0.45 112.172 -176.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 63.11 32.46 15.21 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 124.131 0.895 . . . . 2.19 110.509 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.17 118.69 4.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 1.12 110.426 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -67.96 -40.06 83.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.92 -0.582 . . . . 1.42 112.085 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -62.2 -51.37 68.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.591 -0.277 . . . . 2.01 111.16 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 10.0 tp10 -70.73 -28.26 64.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.358 -0.383 . . . . 1.48 110.462 -177.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.58 -40.86 84.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.423 0.63 . . . . 0.2 109.975 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.423 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.2 t-20 -69.05 -45.53 70.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.122 -0.944 . . . . 0.63 109.78 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.55 -40.49 87.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.364 -0.835 . . . . 1.99 111.149 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.472 HD12 HD21 ' A' ' 209' ' ' LEU . 45.6 mt -72.77 -36.87 67.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.406 -0.361 . . . . 0.2 110.238 -179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 40.6 ttp180 -56.43 -42.13 77.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.213 0.53 . . . . 1.29 110.172 175.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.589 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 99.5 t -71.33 -49.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.665 -0.698 . . . . 0.19 109.925 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 50.2 tp -56.63 -49.7 74.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.922 -1.036 . . . . 0.26 111.095 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -64.61 -36.93 85.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.224 -0.898 . . . . 1.25 110.491 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -68.57 -29.87 68.52 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.739 -0.384 . . . . 0.36 111.018 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 48.6 mt-10 -73.23 -33.78 65.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.311 -0.626 . . . . 2.28 109.311 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.82 -40.29 79.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.41 -0.813 . . . . 0.16 109.835 177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 58.1 t90 -65.13 -41.94 94.35 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.126 -0.943 . . . . 0.19 110.148 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -63.97 -37.98 89.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.043 -0.526 . . . . 2.25 111.089 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 43.4 m -73.71 -5.22 39.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.768 0.318 . . . . 1.16 111.641 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 64.0 m -85.75 -9.46 57.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.181 0.515 . . . . 0.93 110.412 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.685 -0.674 . . . . 1.27 109.748 176.901 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo . . . . . 0 N--CA 1.479 0.635 0 N-CA-C 110.26 -0.708 . . . . 1.89 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 21.9 m -127.81 60.9 1.43 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.34 0.591 . . . . 2.1 110.372 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.524 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 65.62 62.23 4.98 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.37 -0.832 . . . . 1.68 114.323 177.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -164.32 -72.21 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.145 0.472 . . . . 1.97 110.963 172.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 25.9 t -51.08 -47.81 61.77 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.289 0.368 . . . . 1.24 111.632 -177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 209' ' ' LEU . 7.6 p -68.53 -32.95 57.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.657 0.265 . . . . 0.34 111.092 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.432 HG13 ' CE2' ' B' ' 197' ' ' PHE . 43.6 t -69.24 -22.64 26.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.264 0.554 . . . . 0.23 110.256 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.403 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.29 12.14 10.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.867 -0.606 . . . . 0.23 111.625 -178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 35.8 p -108.15 155.31 20.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.917 0.389 . . . . 0.25 110.753 -175.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.38 -32.99 74.92 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.238 -0.653 . . . . 2.46 109.238 174.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.98 88.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.141 -0.936 . . . . 0.27 111.83 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 209' ' ' LEU . 54.4 t80 -64.18 -50.43 68.15 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.658 -0.417 . . . . 0.22 110.565 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.13 -28.36 66.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.1 -0.5 . . . . 0.16 110.972 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -63.76 -49.86 71.34 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 1.25 110.481 175.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.84 -34.02 71.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.284 -0.417 . . . . 1.37 110.867 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . 0.412 ' O ' HD13 ' B' ' 205' ' ' LEU . 2.9 tm? -60.15 -48.01 83.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.915 -0.584 . . . . 0.17 109.726 177.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.466 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 47.3 tt0 -68.81 -35.09 76.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.407 -0.36 . . . . 0.71 110.399 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -57.95 -41.97 94.58 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.827 -0.701 . . . . 0.16 111.742 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.96 -38.04 82.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.722 -0.473 . . . . 1.26 109.722 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 4.9 mp -66.44 -37.17 84.58 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.862 -0.608 . . . . 0.2 110.652 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -63.96 -47.81 78.95 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.781 0.324 . . . . 1.14 110.532 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -66.43 -43.22 86.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 1.13 111.878 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -75.18 -48.45 23.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.831 0.348 . . . . 1.98 111.295 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 6.9 mp -77.34 -21.88 52.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.98 -0.555 . . . . 0.45 112.171 -176.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 62.85 32.48 15.8 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 124.135 0.897 . . . . 2.19 110.593 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -155.15 118.57 4.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 1.11 110.285 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.86 -40.07 83.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.953 -0.567 . . . . 1.41 112.069 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -62.23 -51.13 69.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.648 0.261 . . . . 2.0 111.191 -174.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 9.2 tp10 -71.01 -28.17 64.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.886 0.374 . . . . 1.48 110.422 -177.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -67.54 -41.01 84.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.506 0.669 . . . . 0.21 109.958 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.422 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.4 t-20 -69.13 -45.55 69.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.095 -0.957 . . . . 0.63 109.757 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -59.39 -40.42 86.54 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.404 -0.816 . . . . 1.97 111.245 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.478 HD12 HD21 ' B' ' 209' ' ' LEU . 45.5 mt -72.79 -36.87 67.68 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.336 -0.393 . . . . 0.2 110.284 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . 0.466 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 40.8 ttp180 -56.46 -42.21 77.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.18 0.514 . . . . 1.29 110.125 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.578 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 97.2 t -71.28 -49.66 46.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.634 -0.712 . . . . 0.19 109.969 -178.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 50.0 tp -56.62 -49.43 75.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.908 -1.042 . . . . 0.25 111.115 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -64.8 -37.3 87.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.201 -0.909 . . . . 1.24 110.324 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -68.3 -30.06 68.96 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.758 -0.377 . . . . 0.35 110.908 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 48.3 mt-10 -73.22 -33.24 65.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.415 -0.587 . . . . 2.27 109.415 178.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.17 77.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.399 -0.818 . . . . 0.16 109.701 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.403 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 58.4 t90 -65.32 -41.85 93.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.06 -0.973 . . . . 0.19 110.187 177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -64.13 -37.81 88.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.53 . . . . 2.25 111.146 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 43.8 m -73.99 -4.74 37.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.508 -0.314 . . . . 1.18 111.693 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 66.3 m -85.88 -9.79 56.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.118 0.485 . . . . 0.93 110.426 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 118.553 -0.737 . . . . 1.27 109.917 177.05 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.476 0.486 0 N-CA-C 110.418 -0.647 . . . . 1.91 110.418 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 8.2 p -94.23 -4.19 49.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.945 0.403 . . . . 2.1 111.617 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' GLY . . . . . 0.498 ' O ' ' HG2' ' B' ' 214' ' ' GLU . . . 96.22 73.63 1.17 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.676 -0.773 . . . . 1.67 113.716 173.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -171.68 -59.07 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.995 -0.372 . . . . 1.96 109.995 173.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 29.9 t -58.21 -40.15 80.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.106 -0.497 . . . . 1.24 110.65 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.0 p -70.59 -33.92 55.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-O 120.82 0.343 . . . . 0.35 110.78 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' VAL . . . . . 0.455 HG13 ' CE2' ' A' ' 197' ' ' PHE . 39.0 t -71.48 -19.75 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.704 0.764 . . . . 0.24 109.679 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' ALA . . . . . 0.468 ' HA ' ' CH2' ' A' ' 226' ' ' TRP . . . -86.14 11.59 11.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.468 -0.787 . . . . 0.24 111.466 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 43.9 p -106.02 151.22 24.92 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.26 110.193 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -65.76 -32.9 74.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.7 -0.682 . . . . 2.46 109.304 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.55 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.925 -1.034 . . . . 0.26 111.782 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' PHE . . . . . 0.455 ' CE2' HG13 ' A' ' 192' ' ' VAL . 57.1 t80 -62.22 -50.23 72.59 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.737 0.303 . . . . 0.22 110.244 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -68.75 -28.86 67.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.785 -0.643 . . . . 0.17 111.51 -177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.94 -47.82 73.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.68 0.276 . . . . 1.23 110.386 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -66.64 -37.44 84.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.956 0.407 . . . . 1.37 110.598 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.89 -47.69 84.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.757 . . . . 0.18 109.867 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' GLN . . . . . 0.548 ' OE1' ' HD3' ' A' ' 219' ' ' ARG . 53.1 tt0 -69.04 -31.88 70.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.341 -0.391 . . . . 0.71 110.478 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.78 -41.34 99.61 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.16 111.509 176.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.0 -37.84 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.68 -0.489 . . . . 1.26 109.68 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 209' ' ' LEU . 5.0 mp -66.78 -35.97 81.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.676 -0.693 . . . . 0.19 110.793 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.02 -46.95 82.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.77 0.319 . . . . 1.13 110.677 176.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -66.62 -41.46 88.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.094 -0.503 . . . . 1.13 111.768 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.0 tpt85 -74.69 -48.99 22.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.893 0.377 . . . . 1.97 111.387 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 205' ' ' LEU . 7.0 mp -80.73 -22.58 40.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.659 0.614 . . . . 0.45 112.659 -175.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 14.4 mptt 62.99 35.09 13.46 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.679 0.612 . . . . 2.19 110.626 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -156.61 118.95 3.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.058 0.456 . . . . 1.12 110.592 -176.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -67.97 -40.12 83.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.511 -0.768 . . . . 1.42 111.818 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 217' ' ' LYS . 6.5 m-20 -62.46 -51.34 67.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.377 . . . . 2.01 111.307 -173.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' B' ' 188' ' ' GLY . 23.4 tp10 -70.81 -31.06 67.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.919 0.39 . . . . 1.48 110.313 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.61 -39.44 91.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.2 110.132 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 220' ' ' VAL . 4.3 t-20 -70.29 -47.36 61.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.63 110.1 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 213' ' ' ASP . 68.0 mttm -60.91 -37.01 80.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.775 -0.648 . . . . 1.99 111.094 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 44.4 mt -72.48 -39.97 67.28 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.306 -0.407 . . . . 0.2 110.271 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' ARG . . . . . 0.548 ' HD3' ' OE1' ' A' ' 202' ' ' GLN . 37.2 ttp180 -55.16 -42.31 72.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.142 0.496 . . . . 1.29 110.288 176.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' VAL . . . . . 0.635 ' O ' ' HG3' ' A' ' 224' ' ' GLU . 85.9 t -71.13 -49.56 47.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.558 -0.746 . . . . 0.19 109.851 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.89 -48.5 78.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.937 -1.029 . . . . 0.26 111.025 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -65.14 -36.96 85.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.806 . . . . 1.25 110.317 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -67.46 -31.73 72.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.36 110.846 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 220' ' ' VAL . 44.3 mt-10 -75.42 -31.48 60.39 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.466 -0.568 . . . . 2.28 109.466 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -69.15 -41.63 77.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.428 -0.806 . . . . 0.16 109.662 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' A' ' 193' ' ' ALA . 56.0 t90 -64.38 -37.74 88.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.165 -0.925 . . . . 0.19 110.1 177.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.77 -35.0 79.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.227 -0.442 . . . . 2.25 110.756 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 19.7 t -74.95 -9.68 58.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.938 0.399 . . . . 1.16 110.923 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' SER . . . . . . . . . . . . . 23.2 t -75.42 -12.51 60.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.166 0.508 . . . . 0.93 110.229 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.651 -0.69 . . . . 1.27 110.327 178.773 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.476 0.497 0 N-CA-C 110.379 -0.662 . . . . 1.89 110.379 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' SER . . . . . . . . . . . . . 7.7 p -94.15 -4.29 49.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.831 0.348 . . . . 2.1 111.716 177.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.437 ' O ' ' HG2' ' A' ' 214' ' ' GLU . . . 96.14 73.68 1.18 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.676 -0.773 . . . . 1.68 113.556 173.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -171.3 -59.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.851 0.358 . . . . 1.97 110.045 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -39.99 80.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.948 -0.569 . . . . 1.24 110.721 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.59 -34.18 56.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.34 110.809 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' VAL . . . . . 0.458 HG13 ' CE2' ' B' ' 197' ' ' PHE . 39.1 t -71.38 -19.63 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.688 0.756 . . . . 0.23 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' ALA . . . . . 0.466 ' HA ' ' CH2' ' B' ' 226' ' ' TRP . . . -86.15 11.57 11.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.431 -0.804 . . . . 0.23 111.642 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' THR . . . . . . . . . . . . . 43.6 p -106.05 151.35 24.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.022 0.439 . . . . 0.25 110.165 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -65.99 -32.88 74.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.637 -0.71 . . . . 2.46 109.245 175.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.68 92.76 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.873 -1.058 . . . . 0.27 111.691 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' B' ' 192' ' ' VAL . 56.0 t80 -62.25 -50.26 72.44 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.894 0.378 . . . . 0.22 110.093 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.7 -28.91 67.26 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.624 -0.716 . . . . 0.16 111.558 -177.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -65.88 -47.9 73.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.722 0.296 . . . . 1.25 110.38 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -66.39 -37.71 85.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.995 0.426 . . . . 1.37 110.387 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -59.74 -47.8 84.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.655 -0.702 . . . . 0.17 109.931 178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.543 ' OE1' ' HD3' ' B' ' 219' ' ' ARG . 53.6 tt0 -68.95 -31.81 70.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.369 -0.378 . . . . 0.71 110.5 178.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' GLY . . . . . . . . . . . . . . . -61.82 -41.45 99.63 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.749 -0.739 . . . . 0.16 111.512 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.8 -38.0 85.64 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.691 -0.485 . . . . 1.26 109.691 177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' B' ' 209' ' ' LEU . 5.0 mp -66.63 -36.03 81.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.2 110.806 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -64.03 -46.76 83.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.82 0.343 . . . . 1.14 110.6 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.8 -41.25 87.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 1.13 111.926 -178.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -74.87 -49.11 21.59 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.833 0.349 . . . . 1.98 111.292 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' B' ' 205' ' ' LEU . 7.0 mp -80.67 -22.66 40.24 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.524 0.564 . . . . 0.45 112.524 -175.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . . . . . . . . . 14.3 mptt 62.95 34.98 13.66 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.658 0.599 . . . . 2.19 110.717 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -156.56 118.86 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.076 0.465 . . . . 1.11 110.536 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -67.97 -40.26 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.551 -0.749 . . . . 1.41 111.866 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.12 -51.44 67.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 2.0 111.34 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 188' ' ' GLY . 22.0 tp10 -70.8 -31.04 67.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.923 0.392 . . . . 1.48 110.274 -178.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' ALA . . . . . . . . . . . . . . . -65.69 -39.4 91.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.412 0.625 . . . . 0.21 110.025 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' ASN . . . . . 0.464 ' O ' HG23 ' B' ' 220' ' ' VAL . 4.3 t-20 -70.25 -47.45 61.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.208 -0.905 . . . . 0.63 110.099 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.9 -37.04 80.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.77 -0.65 . . . . 1.97 111.013 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.1 mt -72.43 -40.01 67.42 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.325 -0.398 . . . . 0.2 110.203 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 219' ' ' ARG . . . . . 0.543 ' HD3' ' OE1' ' B' ' 202' ' ' GLN . 36.9 ttp180 -55.14 -42.18 72.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.088 0.47 . . . . 1.29 110.299 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 220' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' B' ' 224' ' ' GLU . 79.0 t -71.27 -49.59 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.19 109.816 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . . 60.7 tp -56.73 -48.73 77.11 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.961 -1.018 . . . . 0.25 111.039 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 222' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.01 -37.01 86.23 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.462 -0.79 . . . . 1.24 110.291 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 223' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.32 -31.96 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.012 -0.275 . . . . 0.35 110.801 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 224' ' ' GLU . . . . . 0.625 ' HG3' ' O ' ' B' ' 220' ' ' VAL . 43.8 mt-10 -75.21 -31.65 60.95 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.525 -0.546 . . . . 2.27 109.525 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 225' ' ' ALA . . . . . . . . . . . . . . . -68.87 -41.68 78.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.523 -0.762 . . . . 0.16 109.65 175.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 226' ' ' TRP . . . . . 0.466 ' CH2' ' HA ' ' B' ' 193' ' ' ALA . 56.3 t90 -64.39 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.251 -0.886 . . . . 0.19 110.132 177.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 227' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.9 -34.87 78.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.323 -0.399 . . . . 2.25 110.658 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 24.2 t -74.63 -10.26 59.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.8 0.333 . . . . 1.18 110.891 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 229' ' ' SER . . . . . . . . . . . . . 23.1 t -75.24 -12.56 60.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.181 0.515 . . . . 0.93 110.371 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 230' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.636 -0.697 . . . . 1.27 110.467 178.667 . . . . . . . . 0 0 . 1 stop_ save_