data_2w0t_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 2w0t _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.623 0.249 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 97.3 Cg_endo -84.81 132.33 4.73 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.624 2.216 . . . . 0.0 112.775 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.23 102.17 8.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.48 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.0 t -79.08 138.28 20.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.788 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -84.2 120.48 26.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.539 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -69.19 -20.54 63.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.838 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.5 -58.26 2.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.44 -29.68 16.91 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.39 -19.49 53.63 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.574 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.7 mt -54.44 134.36 17.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.815 0.34 . . . . 0.0 111.449 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.8 t -114.93 141.71 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.402 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.48 -173.4 20.62 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.978 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 p -89.78 142.65 27.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.75 -42.56 5.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -1.84 16.66 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.41 -28.02 7.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.317 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 0.8 OUTLIER -87.56 160.41 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 111.451 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.93 110.43 0.23 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.347 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.2 m -62.58 -27.31 69.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.397 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 1.1 ttmt -50.76 -60.28 3.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.801 0.334 . . . . 0.0 111.166 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.408 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.6 p -116.96 -40.37 3.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.71 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 82.93 -21.6 0.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.653 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -68.22 -32.38 72.55 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -119.49 142.97 47.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -66.26 -11.22 48.94 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -152.85 155.27 36.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.887 0.375 . . . . 0.0 111.662 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.424 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -63.22 -34.06 64.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.065 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 82.5 p -58.94 -44.31 91.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.926 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.9 m -58.69 -24.6 61.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.534 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.82 -50.75 10.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.797 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -69.36 -19.28 63.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.407 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.4 m -82.1 -51.51 7.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.082 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.0 -26.0 68.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.85 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.37 -46.11 9.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.307 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.02 0.7 54.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.277 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 55.0 t30 . . . . . 0 C--N 1.33 -0.273 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.649 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.548 0.213 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.38 136.81 37.99 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.58 2.186 . . . . 0.0 112.43 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.97 116.31 22.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.876 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -81.49 136.53 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.534 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -80.07 119.86 23.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.271 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.35 -22.6 66.83 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 2.9 tpt -91.21 -58.26 2.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.06 -29.83 19.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 98.41 -22.04 42.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.266 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.5 mm -54.79 136.34 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.961 0.41 . . . . 0.0 111.085 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.5 t -108.03 139.9 28.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.889 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.467 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.7 158.52 27.72 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.299 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.2 p -68.99 143.68 54.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.83 0.315 . . . . 0.0 110.399 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -44.84 -41.92 7.47 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.91 -4.37 27.87 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.92 -27.32 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.303 . . . . 0.0 111.122 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.467 ' CE2' ' HA2' ' A' ' 97' ' ' GLY . 1.4 m-85 -88.28 158.95 18.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.26 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.82 118.57 1.66 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.205 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 26.7 t -65.52 -27.0 68.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.542 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.455 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 16.4 tptp -52.32 -49.07 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 7.4 p -128.12 -42.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.335 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 106' ' ' THR . 22.9 mmtm 84.79 -20.88 0.27 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.455 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -75.33 -25.0 57.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.866 0.365 . . . . 0.0 110.616 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.41 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 45.6 m-85 -120.75 133.34 55.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.175 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.5 p -63.02 -12.75 28.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -151.62 153.78 35.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.004 0.43 . . . . 0.0 111.884 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.43 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.0 p -60.95 -35.49 65.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.045 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.5 t -59.62 -40.77 88.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.773 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.41 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 8.5 m -60.8 -27.66 68.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.224 179.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 t -74.73 -53.82 8.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.878 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -70.55 -17.58 62.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.59 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.1 m -81.83 -49.24 10.6 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.6 -25.25 65.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.778 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -83.93 -50.85 7.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.246 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.0 t -61.15 -51.43 69.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.18 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.671 179.668 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.74 0.305 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.33 131.3 3.53 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.887 2.392 . . . . 0.0 112.759 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -116.78 106.65 13.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.906 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.7 t -82.06 126.31 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.416 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.33 122.45 22.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.414 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -66.3 -22.15 66.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.78 -58.23 2.55 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 m -86.13 -33.39 20.9 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.18 16.91 54.95 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.425 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.72 132.87 34.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.423 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -108.77 135.93 46.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.382 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.36 171.49 30.24 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.288 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 39.0 p -72.45 137.6 46.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.573 0.225 . . . . 0.0 110.581 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -43.27 -40.94 3.72 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.27 0.23 6.79 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -118.97 -19.15 8.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.646 0.26 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.439 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.5 m-85 -93.38 158.84 15.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.154 0.502 . . . . 0.0 111.745 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.444 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.7 t80 -44.63 111.68 0.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.32 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 69.6 m -64.26 -31.16 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.426 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.444 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -49.63 -57.29 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.221 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -113.79 -46.1 3.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 85.33 -26.09 0.11 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.424 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 14.1 mtm180 -69.86 -32.99 71.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.875 0.369 . . . . 0.0 110.597 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -118.25 138.48 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.437 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.439 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 29.5 p -63.12 -13.73 40.04 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.7 p -150.55 152.96 34.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.975 0.417 . . . . 0.0 111.739 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.3 p -62.79 -33.75 61.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.991 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 8.0 t -60.7 -37.97 83.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.803 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 58.1 m -62.87 -24.7 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.162 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -50.24 10.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -70.53 -19.52 62.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.398 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 11.3 t -80.98 -51.17 8.82 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.802 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -63.69 -26.01 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.65 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.47 -43.36 11.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.438 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -87.56 -0.34 56.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.395 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.87 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.752 0.311 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.2 Cg_endo -86.53 131.15 3.38 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.885 2.39 . . . . 0.0 112.88 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.425 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -108.89 164.63 12.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.787 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 20.7 t -138.13 126.28 30.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.498 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -73.85 108.88 6.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.076 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.26 -19.18 7.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.304 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.2 tpt -100.29 -58.68 1.85 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.83 -30.89 40.52 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 94.09 -21.0 44.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.454 -0.879 . . . . 0.0 112.431 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 33.5 mm -52.49 133.71 14.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.528 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.425 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 16.4 t -110.43 140.86 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.252 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.33 -167.79 14.74 Favored Glycine 0 C--O 1.227 -0.298 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.802 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 70.4 p -98.38 142.16 30.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.969 0.384 . . . . 0.0 110.339 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.65 -42.53 7.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.08 -1.13 16.12 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.06 -31.29 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.862 0.363 . . . . 0.0 111.091 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -81.26 161.12 24.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.334 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 1.2 t80 -44.69 118.08 1.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.139 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.8 m -71.95 -29.27 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.588 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 19.5 tptp -57.84 -38.71 76.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.43 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.561 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 44.1 p -128.21 -48.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 106' ' ' THR . 11.6 mmtp 84.09 -31.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 55.9 mtm180 -62.09 -46.99 86.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.837 0.351 . . . . 0.0 110.28 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -105.17 143.28 33.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.474 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.417 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 30.7 p -66.72 -11.01 52.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -154.06 156.44 37.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.938 0.399 . . . . 0.0 111.689 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.437 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.8 p -64.93 -33.73 65.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.91 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -45.47 86.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.838 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 95.4 m -59.33 -24.48 63.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.334 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.6 t -76.1 -50.17 15.39 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.726 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -21.54 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.491 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -49.27 12.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.886 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -65.87 -25.88 67.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.873 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.0 p -88.01 -40.06 14.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.132 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 1.1 t -90.43 -4.09 57.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.845 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 47.4 t30 . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.684 0.278 . . . . 0.0 111.3 -179.763 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.254 0 CA-C-O 120.524 0.202 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_exo -65.06 126.45 16.49 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.551 2.167 . . . . 0.0 112.697 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -118.0 102.51 9.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.783 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 t -79.24 132.74 31.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.432 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 32.2 t -80.41 121.7 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.582 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -69.39 -20.2 63.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.775 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 7.8 tpt -89.52 -58.2 2.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 6.6 m -89.15 -31.7 17.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.09 17.96 51.82 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.523 -0.846 . . . . 0.0 112.473 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mm -91.77 134.05 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.384 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.2 t -109.92 137.51 41.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.182 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.54 -178.05 25.04 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.983 179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.7 p -81.87 136.74 35.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.789 0.294 . . . . 0.0 110.249 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mtp180 -43.2 -38.42 2.5 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.64 3.83 3.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.17 -21.05 6.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.688 0.28 . . . . 0.0 111.435 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.442 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.8 m-85 -91.07 160.71 15.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.09 0.471 . . . . 0.0 111.504 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.48 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.57 108.23 0.11 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.096 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 t -57.54 -42.54 83.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.842 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.48 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 2.8 mmpp? -46.5 -60.29 2.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.45 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -102.52 -52.41 3.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.048 -179.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.454 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 86.57 -27.31 0.08 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.507 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.94 -32.57 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.9 0.381 . . . . 0.0 110.72 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -117.4 144.41 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.644 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.3 p -66.08 -11.36 48.15 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.9 p -154.87 157.38 37.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.902 0.382 . . . . 0.0 111.644 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.4 p -65.29 -34.77 72.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.978 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.3 p -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.736 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.71 -22.04 63.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.389 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.88 -48.39 11.59 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -70.72 -20.59 62.64 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 5.0 t -78.95 -50.7 10.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.95 -24.17 67.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.529 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.5 p -88.19 -34.39 17.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.805 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 66.4 m -93.81 -6.17 46.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.013 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 58.6 m-80 . . . . . 0 C--N 1.332 -0.182 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 CA--C 1.528 0.12 0 CA-C-O 120.76 0.314 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -85.73 131.58 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.791 2.327 . . . . 0.0 112.792 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.81 99.52 7.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.416 ' CG1' HG21 ' A' ' 96' ' ' VAL . 38.5 t -79.08 126.27 38.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.434 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.16 115.22 10.05 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -71.59 -21.24 61.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.704 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -13.26 23.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.441 ' CB ' HD13 ' A' ' 95' ' ' ILE . 55.8 m -132.05 -43.69 0.96 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 118.131 0.423 . . . . 0.0 111.666 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 119.35 -32.48 5.05 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.441 HD13 ' CB ' ' A' ' 93' ' ' CYS . 2.5 mp -52.54 132.33 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.84 0.352 . . . . 0.0 111.855 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.416 HG21 ' CG1' ' A' ' 89' ' ' VAL . 10.9 t -115.55 141.77 31.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.704 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.43 -176.73 23.71 Favored Glycine 0 C--O 1.228 -0.273 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.116 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.9 p -86.99 142.19 28.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.791 0.296 . . . . 0.0 110.292 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.53 -41.56 2.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.95 -1.58 10.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.04 -17.62 8.95 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.412 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 2.2 m-85 -97.2 159.05 15.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.022 0.439 . . . . 0.0 111.669 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.461 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 4.7 t80 -44.93 113.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.9 t -59.91 -39.53 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.776 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.461 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -46.68 -60.31 2.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.81 0.338 . . . . 0.0 111.568 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.435 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 22.5 p -106.61 -52.16 2.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 84.77 -23.07 0.18 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.461 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.0 -27.93 60.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.686 0.279 . . . . 0.0 110.922 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -119.52 137.41 53.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.465 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 26.9 p -57.68 -15.01 6.49 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.0 p -152.24 154.56 36.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.997 0.427 . . . . 0.0 112.001 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.445 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -63.26 -35.82 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.023 178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.6 p -57.85 -38.97 76.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.614 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.9 m -60.93 -24.41 66.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.347 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 -51.14 10.01 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 ptp85 -70.36 -17.58 63.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.321 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.3 m -83.94 -50.06 8.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.14 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.85 -24.04 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.864 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.1 t -88.11 -49.34 7.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.931 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 2.0 t -77.9 -58.31 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.995 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 C--N 1.33 -0.245 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.789 0.328 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.27 135.21 22.22 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.019 2.479 . . . . 0.0 112.613 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.57 123.02 39.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.638 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.7 t -80.31 144.19 11.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.67 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 48.7 t -90.06 119.79 30.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.476 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -64.23 -23.52 67.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -91.61 -58.17 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.0 -29.33 19.57 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.77 -23.18 37.11 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.978 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.6 mm -53.9 137.12 14.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.933 0.397 . . . . 0.0 111.059 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.2 t -108.53 138.44 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.704 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.72 150.86 22.92 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.086 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.0 p -57.61 138.62 55.11 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -46.52 -36.52 6.82 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -70.26 0.67 5.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.55 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.58 -19.41 7.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.318 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -92.08 158.07 16.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.439 ' CZ ' ' HB ' ' A' ' 112' ' ' VAL . 2.2 t80 -45.2 115.35 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.113 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 33.4 p -62.8 -28.9 70.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.555 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.434 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -54.12 -60.5 3.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 0.0 111.187 -179.602 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.442 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.6 OUTLIER -107.34 -46.25 3.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.078 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.97 -26.68 0.1 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.515 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 7.5 mtm-85 -71.97 -23.05 61.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -121.58 140.72 51.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.6 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.2 p -66.94 -12.14 58.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.46 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.5 p -152.91 154.85 35.88 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.441 . . . . 0.0 112.059 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -62.91 -35.57 71.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.911 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.2 p -58.21 -40.63 82.13 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.792 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.56 -24.53 65.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.406 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -79.91 -49.36 12.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -20.66 62.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.408 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 5.6 m -80.25 -52.02 8.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.782 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.4 t80 -63.7 -25.89 68.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.715 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -88.69 -42.86 11.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.429 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.6 t -88.71 -2.02 58.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.247 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.838 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 CA--C 1.53 0.186 0 CA-C-O 120.488 0.185 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -61.52 133.03 43.53 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.51 2.14 . . . . 0.0 112.442 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -121.84 114.24 20.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.7 t -78.99 135.27 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.432 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 38.6 t -80.97 120.18 24.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.744 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.442 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -67.43 -21.39 65.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.971 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -58.32 2.53 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.3 m -90.85 -27.72 18.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.46 -19.91 52.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.485 -0.865 . . . . 0.0 112.146 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.3 mm -57.76 142.16 13.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.987 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.3 t -115.67 142.91 26.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.952 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.426 ' HA2' ' CE1' ' A' ' 102' ' ' PHE . . . -150.34 161.03 28.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.112 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 71.1 p -69.26 140.11 54.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.416 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 12.5 ptm180 -41.58 -41.25 2.11 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -71.31 0.66 7.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.94 -21.15 6.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.577 0.227 . . . . 0.0 111.594 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.426 ' CE1' ' HA2' ' A' ' 97' ' ' GLY . 1.4 m-85 -92.64 161.25 14.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.933 0.397 . . . . 0.0 111.33 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 3.3 t80 -44.65 100.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.082 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.407 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 52.9 m -55.98 -25.01 42.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.731 -179.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 1.1 tptp -54.4 -59.83 4.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 111.044 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.437 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.0 OUTLIER -117.19 -40.64 3.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.84 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.437 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 84.32 -17.52 0.46 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.663 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -61.68 -46.09 91.23 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.781 0.324 . . . . 0.0 110.588 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.457 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 9.0 m-85 -108.44 160.26 16.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.55 -5.78 49.09 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -161.6 164.33 29.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.098 0.475 . . . . 0.0 112.062 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.435 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -66.6 -44.58 89.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.299 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 p -57.94 -36.11 72.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.853 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -67.23 -18.96 65.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.498 178.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 7.0 p -85.88 -46.73 10.32 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.623 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -74.78 -20.74 59.68 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 39.6 m -81.32 -53.63 6.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.52 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 15.7 t80 -67.15 -20.06 65.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.149 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -88.23 -49.86 6.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.203 0.525 . . . . 0.0 110.894 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 t -80.22 6.3 12.21 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.761 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.2 m-80 . . . . . 0 C--N 1.332 -0.182 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.825 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.707 0.289 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.9 Cg_endo -82.25 128.62 5.66 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.76 2.307 . . . . 0.0 113.277 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -106.5 169.85 8.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.814 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -139.29 126.32 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.84 0.352 . . . . 0.0 111.908 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 35.5 t -78.51 114.63 17.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.399 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -63.68 -18.63 64.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.244 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.5 tpt -94.38 -58.37 2.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.7 m -88.18 -25.37 22.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.13 22.13 61.54 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.385 -0.912 . . . . 0.0 112.24 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.9 mm -89.69 128.45 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.79 0.328 . . . . 0.0 110.479 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.445 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 6.1 t -103.65 134.56 44.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.407 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.15 -169.1 15.89 Favored Glycine 0 C--O 1.228 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.122 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.7 p -95.3 137.25 34.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.4 ' HG2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -43.58 -40.46 4.04 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.8 3.39 8.15 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.02 -28.61 4.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 111.436 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.438 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 0.4 OUTLIER -79.09 161.53 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 111.82 -179.407 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.439 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.3 t80 -44.67 106.4 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.237 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 47.5 m -62.94 -25.43 68.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.536 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.439 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -51.49 -60.39 3.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.778 0.323 . . . . 0.0 111.139 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.441 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.2 p -113.5 -36.76 4.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.441 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.57 -34.25 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.494 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.59 -51.06 68.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.819 0.342 . . . . 0.0 110.685 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -101.93 140.71 35.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.652 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.438 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 31.3 p -64.18 -14.45 55.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 112.31 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.1 p -151.67 154.22 35.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.842 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -63.16 -32.77 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.746 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 116' ' ' ARG . 4.2 t -57.74 -44.69 86.21 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.741 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 65.2 m -59.65 -27.67 66.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.171 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 t -72.12 -55.29 7.56 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.978 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -69.28 -18.1 63.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.907 0.384 . . . . 0.0 110.122 178.816 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 1.8 m -79.55 -54.02 6.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -61.17 -24.77 66.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.079 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.8 t -83.23 -52.93 6.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.512 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -50.9 8.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 37.8 t30 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 3.5 mm-40 . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.466 0.174 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 6.2 Cg_exo -77.86 131.54 11.22 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.359 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -120.35 98.93 6.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.69 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.6 t -79.74 133.76 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.249 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -78.08 118.66 20.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.646 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.485 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 7.1 mm-40 -65.79 -20.51 66.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.852 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -58.23 2.47 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.7 m -88.58 -31.89 18.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.05 19.28 43.42 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.865 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 3.2 mp -89.96 128.39 41.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.116 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.71 137.3 32.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.253 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.51 -174.96 22.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.766 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 p -90.49 143.17 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.952 0.376 . . . . 0.0 110.333 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -43.96 -42.23 5.8 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -71.67 0.01 9.79 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.91 -28.27 7.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 111.321 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.41 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 1.5 m-85 -87.96 160.08 18.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.2 t80 -44.98 105.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.4 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.4 p -57.43 -26.4 61.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.435 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -53.62 -60.04 3.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.163 -179.795 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.431 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.3 p -115.1 -43.55 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 83.57 -21.32 0.28 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.498 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -67.69 -34.07 76.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.74 0.305 . . . . 0.0 110.834 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.486 ' CE2' ' CD2' ' A' ' 118' ' ' TYR . 19.2 m-85 -118.42 148.22 42.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.502 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.41 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 14.9 p -66.83 -7.6 22.72 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.4 p -163.31 166.16 23.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.928 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.66 -46.19 86.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.453 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.5 p -56.99 -39.69 75.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.14 0.495 . . . . 0.0 109.815 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.6 t -63.71 -18.91 64.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.478 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.1 t -85.56 -47.17 10.13 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -73.24 -19.73 61.01 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 8.4 t -82.19 -53.38 6.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.476 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.486 ' CD2' ' CE2' ' A' ' 109' ' ' PHE . 14.4 t80 -65.19 -20.45 66.45 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.141 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.4 t -87.99 -50.37 6.46 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.488 . . . . 0.0 110.632 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.3 m -81.48 3.61 24.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.071 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 117' ' ' SER . 0.8 OUTLIER . . . . . 0 N--CA 1.462 0.137 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.93 136.9 3.74 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.979 2.452 . . . . 0.0 112.427 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.73 108.25 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 9.8 t -81.62 128.08 39.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -75.43 120.43 20.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.535 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.434 ' HG2' ' CE1' ' A' ' 118' ' ' TYR . 1.5 tt0 -68.28 -17.77 64.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.719 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 9.6 tpt -92.62 -58.14 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.9 m -88.18 -31.99 18.83 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 -178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.73 19.01 49.87 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.254 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -93.82 132.98 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 120.951 0.405 . . . . 0.0 110.063 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -105.04 133.47 49.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.387 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.57 151.59 23.59 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.833 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.6 p -59.14 140.31 56.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.019 0.41 . . . . 0.0 110.604 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.405 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 32.2 ptt85 -44.56 -33.9 1.93 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.24 -0.436 . . . . 0.0 112.007 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -68.13 -2.9 8.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.07 -1.13 7.77 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -109.55 158.06 18.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.178 0.513 . . . . 0.0 111.73 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.9 t80 -44.43 100.59 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.178 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.4 OUTLIER -49.87 -28.39 6.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.884 -179.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.454 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -50.44 -54.64 20.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.848 0.356 . . . . 0.0 111.216 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 2.1 p -128.01 -38.01 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.147 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 8.3 mmtp 81.27 -9.52 1.29 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.535 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -68.85 -34.29 75.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.601 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -118.35 143.74 46.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.1 p -63.7 -13.09 40.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -155.8 158.27 37.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.988 0.423 . . . . 0.0 111.907 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.4 p -65.73 -36.06 76.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.837 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -58.15 -39.2 78.2 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.568 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.67 -21.58 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.367 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.6 p -82.34 -48.41 11.19 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.673 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -71.95 -19.68 61.86 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.422 ' O ' ' N ' ' A' ' 121' ' ' ASN . 4.0 m -79.06 -51.88 8.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.434 ' CE1' ' HG2' ' A' ' 91' ' ' GLU . 1.9 t80 -63.56 -23.58 67.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.554 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 16.6 p -88.37 -35.74 16.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.739 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -92.59 -6.16 50.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.981 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 117' ' ' SER . 71.3 m-80 . . . . . 0 C--N 1.33 -0.252 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.812 0.339 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HB2' ' CG1' ' A' ' 96' ' ' VAL . 92.2 Cg_endo -85.24 149.47 10.48 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.865 2.377 . . . . 0.0 112.546 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.71 120.9 33.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.0 t -79.11 137.74 21.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.624 -179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 39.0 t -81.16 114.9 20.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.96 -22.1 62.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -95.9 -58.31 2.13 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.409 ' CB ' ' CD1' ' A' ' 95' ' ' ILE . 4.4 m -89.29 -28.98 19.51 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.12 -24.32 32.32 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.474 -179.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.409 ' CD1' ' CB ' ' A' ' 93' ' ' CYS . 4.5 mp -52.71 138.1 11.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.914 0.388 . . . . 0.0 111.01 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.403 ' CG1' ' HB2' ' A' ' 87' ' ' PRO . 8.7 t -113.33 141.3 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.666 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.411 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.73 156.12 26.52 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.116 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.6 p -65.8 142.71 57.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.514 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -44.41 -34.96 2.2 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.449 ' N ' ' HG2' ' A' ' 99' ' ' ARG . 2.7 tp10 -74.17 -0.68 17.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.24 -18.9 7.25 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.411 ' CE2' ' HA2' ' A' ' 97' ' ' GLY . 1.5 m-85 -91.97 161.38 14.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.7 97.28 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.203 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.421 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 9.0 t -47.74 -28.88 2.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.064 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 0.8 OUTLIER -54.43 -60.42 3.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 p -119.64 -39.25 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 81.64 -14.15 0.82 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.719 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -64.19 -39.34 93.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.758 0.313 . . . . 0.0 110.549 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.429 ' CD1' ' HA ' ' A' ' 115' ' ' SER . 11.5 m-85 -112.07 153.51 26.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.386 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.5 p -68.39 -7.69 33.72 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -165.53 168.41 16.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.051 0.453 . . . . 0.0 111.94 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -68.12 -43.27 85.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.237 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.6 t -57.66 -40.61 79.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.8 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.34 -19.06 65.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.563 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.429 ' HA ' ' CD1' ' A' ' 109' ' ' PHE . 4.9 p -84.29 -45.35 12.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.53 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -74.21 -19.84 60.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.848 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 3.8 t -80.81 -53.88 6.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.584 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -66.72 -22.39 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.999 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 t -88.31 -48.78 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.917 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.6 m -81.12 2.88 25.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.146 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 117' ' ' SER . 58.1 m-80 . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.878 0.371 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.94 128.42 3.75 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.857 2.371 . . . . 0.0 112.79 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.442 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -110.02 167.3 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.571 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.1 t -137.95 126.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.591 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.73 110.53 8.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.476 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 6.5 mp0 -58.38 -21.13 49.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.2 tpt -96.9 -58.52 2.01 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -82.96 -27.85 30.2 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.6 20.89 60.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.095 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -88.72 129.07 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.442 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 6.0 t -104.93 136.35 38.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 111.328 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.43 -169.68 16.73 Favored Glycine 0 C--O 1.227 -0.289 0 N-CA-C 111.736 -0.546 . . . . 0.0 111.736 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.6 p -91.43 136.65 32.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.083 0.441 . . . . 0.0 110.137 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.455 ' HA ' ' CE ' ' A' ' 107' ' ' LYS . 20.7 mtp85 -42.9 -38.43 2.19 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.66 9.19 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.76 -34.66 4.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.999 0.428 . . . . 0.0 110.856 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -74.09 161.4 30.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 112.075 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.452 ' O ' ' HA ' ' A' ' 107' ' ' LYS . 4.6 t80 -44.34 152.16 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.886 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.1 m -96.16 -46.2 6.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.315 . . . . 0.0 111.559 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.442 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -47.8 -49.52 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -179.299 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.404 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 74.1 p -105.29 -49.0 3.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.33 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.455 ' CE ' ' HA ' ' A' ' 99' ' ' ARG . 0.1 OUTLIER 82.95 -46.73 0.14 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.157 -179.632 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -60.88 -45.28 95.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.984 0.421 . . . . 0.0 110.487 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -96.88 145.38 25.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -68.73 -9.65 51.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -155.96 158.41 37.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.956 0.408 . . . . 0.0 111.757 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.442 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.0 p -63.96 -36.48 76.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.896 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.4 t -57.27 -44.05 83.63 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.731 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.7 m -60.0 -26.13 65.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.017 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 p -73.46 -52.21 14.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -69.55 -20.81 63.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.245 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.85 -53.1 7.44 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.996 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.8 t80 -63.74 -25.15 68.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.987 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.5 t -81.26 -55.48 4.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.6 m -79.44 -52.42 8.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.47 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 t30 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.737 -179.216 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.428 0.156 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.27 129.69 29.35 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.46 2.107 . . . . 0.0 112.661 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.93 109.7 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.615 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.3 t -82.29 131.71 33.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.834 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.402 ' O ' ' HA3' ' A' ' 94' ' ' GLY . 45.1 t -79.43 119.81 22.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.44 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.473 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.2 mt-10 -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.1 tpt -88.52 -58.26 2.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 11.7 m -86.96 -35.6 18.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.679 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 90' ' ' CYS . . . 103.99 -26.45 23.09 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.102 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -52.61 132.6 14.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 111.229 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 t -106.67 139.05 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.242 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.456 ' HA2' ' CE1' ' A' ' 102' ' ' PHE . . . -150.24 151.56 23.59 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 72.2 p -61.34 140.0 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.571 0.224 . . . . 0.0 110.895 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -39.85 -45.46 1.81 Allowed 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.04 -1.15 3.8 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.42 -10.66 9.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.63 0.252 . . . . 0.0 111.371 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.456 ' CE1' ' HA2' ' A' ' 97' ' ' GLY . 1.6 m-85 -105.45 159.09 16.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.208 0.527 . . . . 0.0 111.41 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.459 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 5.1 t80 -44.63 104.43 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.185 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.2 m -54.43 -35.29 62.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.875 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.459 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 0.3 OUTLIER -47.92 -60.36 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.728 0.299 . . . . 0.0 111.434 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 33.0 p -111.0 -46.39 3.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.717 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 106' ' ' THR . 6.4 mmtp 80.33 -15.67 0.73 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.841 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -74.56 -27.59 60.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.908 0.385 . . . . 0.0 110.394 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -123.54 140.0 53.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.516 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 25.1 p -60.16 -13.79 14.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.2 p -151.74 154.41 36.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.918 0.39 . . . . 0.0 111.859 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.437 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.56 -36.27 74.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.8 t -58.67 -40.08 82.51 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.733 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 118' ' ' TYR . 9.9 m -61.77 -23.76 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.303 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.3 p -79.33 -52.94 7.44 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.763 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.4 ptt-85 -70.05 -17.66 63.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.281 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.423 ' O ' ' ND2' ' A' ' 121' ' ' ASN . 4.6 m -82.79 -47.95 11.34 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.819 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.473 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.5 t80 -69.89 -21.59 63.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.934 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 p -88.18 -60.49 1.95 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.6 m -57.83 -44.03 86.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.035 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.423 ' ND2' ' O ' ' A' ' 117' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.608 0.242 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.535 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 34.5 Cg_exo -60.76 124.12 14.36 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.556 2.171 . . . . 0.0 112.21 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.41 ' O ' ' CE2' ' A' ' 102' ' ' PHE . . . -110.32 100.97 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.11 140.19 17.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.914 0.388 . . . . 0.0 111.479 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.15 121.54 19.47 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -76.14 11.45 1.49 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.361 -0.836 . . . . 0.0 113.073 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.7 tpt -116.52 -55.23 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 95' ' ' ILE . 6.4 m -96.06 -47.7 5.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.429 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 114.35 6.33 20.15 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.429 ' CD1' ' HB2' ' A' ' 93' ' ' CYS . 2.0 mm -52.35 -177.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.411 ' H ' ' CG2' ' A' ' 95' ' ' ILE . 3.2 t -142.67 142.41 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-O 121.306 0.574 . . . . 0.0 111.571 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.99 -167.91 15.14 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.115 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.9 155.65 20.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -42.49 -36.43 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -99.18 -38.06 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.75 -15.32 52.79 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.49 ' CD1' ' HA2' ' A' ' 97' ' ' GLY . 0.3 OUTLIER -95.33 177.09 5.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.002 0.43 . . . . 0.0 111.486 -179.585 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 105' ' ' LYS . 10.3 t80 -61.53 120.64 10.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.138 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 87.0 p -70.85 -57.6 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -41.54 -29.96 0.19 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.8 m -126.3 -53.25 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 111.573 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 71.98 11.1 6.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.216 -179.597 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.31 -33.73 9.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.0 110.863 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -116.85 164.16 15.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.172 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 1.1 p -59.76 -38.13 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.999 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 p -150.34 154.09 37.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 0.0 111.575 -178.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.465 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 13.9 p -49.69 -34.22 8.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.274 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.433 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 5.9 t -65.66 -45.28 83.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.401 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t -57.34 -44.9 84.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.433 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.0 t -58.9 -63.15 1.4 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.649 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -51.47 -26.15 7.72 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.941 0.4 . . . . 0.0 110.187 179.322 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.8 t -68.51 -57.22 6.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -48.23 -39.6 21.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.938 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 8.1 t -68.19 -53.91 21.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.543 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 47.0 m -75.38 -3.05 31.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.091 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.3 t30 . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.654 0.264 . . . . 0.0 111.291 -179.839 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.533 0.206 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.04 138.89 75.82 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.455 2.104 . . . . 0.0 112.364 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.405 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -134.13 129.41 35.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.74 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 17.8 t -87.45 134.02 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.199 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 46.9 t -73.7 121.64 21.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.109 0.481 . . . . 0.0 110.772 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.512 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.6 mm-40 -63.25 -25.82 68.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.715 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.98 -58.38 2.49 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.14 -33.6 19.37 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.07 16.91 45.55 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.616 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.2 mm -91.57 134.44 30.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' ' 88' ' ' ALA . 2.9 t -99.23 137.6 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.348 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.437 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.57 -168.05 15.08 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.953 179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 74.8 p -104.32 140.71 37.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.644 0.259 . . . . 0.0 110.527 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.36 -37.47 3.37 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -78.82 7.71 6.64 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -179.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.87 -33.19 3.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.852 0.358 . . . . 0.0 111.344 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.463 ' CG ' ' HA ' ' A' ' 110' ' ' CYS . 2.4 m-30 -74.41 162.29 28.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.722 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.481 ' HB2' ' O ' ' A' ' 110' ' ' CYS . 8.0 t80 -55.88 89.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.433 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.1 m -41.33 -31.73 0.25 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.564 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 2.1 tppt? -46.04 -46.47 16.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 1.1 p -122.81 -37.11 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.066 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.556 ' HB2' ' O ' ' A' ' 106' ' ' THR . 10.9 mmtp 78.14 -36.94 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.684 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -62.04 -32.49 73.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.412 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.684 ' HB3' ' SG ' ' A' ' 114' ' ' CYS . 31.6 m-85 -114.39 129.84 56.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.411 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 103' ' ' PHE . 1.8 p -48.64 -63.03 1.2 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.994 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.3 p -106.8 165.85 11.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.313 0.578 . . . . 0.0 112.434 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.418 ' HB ' ' CE1' ' A' ' 103' ' ' PHE . 10.8 p -70.95 -26.29 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.021 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.1 p -66.77 -55.02 16.83 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.2 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.684 ' SG ' ' HB3' ' A' ' 109' ' ' PHE . 30.5 p -59.25 -21.17 59.18 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 5.3 p -77.65 -50.97 11.39 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.526 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -64.98 -19.66 66.09 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 1.1 m -74.6 -54.18 7.96 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.512 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.3 t80 -57.22 -26.46 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 178.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 55.2 p -85.35 -32.91 22.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.027 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.2 t -104.15 -8.43 19.44 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 117' ' ' SER . 3.9 m-80 . . . . . 0 C--N 1.33 -0.259 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.113 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -92.13 115.61 0.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.491 2.127 . . . . 0.0 112.594 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.401 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -109.05 160.81 15.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.58 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.77 127.49 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.796 0.331 . . . . 0.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -80.07 113.62 18.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.482 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.85 -21.42 56.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.6 tpt -94.97 -58.46 2.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 22.6 m -80.44 -27.24 38.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.5 17.77 75.08 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.766 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.6 mm -89.14 132.42 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 CA-C-O 121.032 0.444 . . . . 0.0 110.476 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.401 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 2.7 t -99.67 130.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.531 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . 0.466 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.65 150.63 22.66 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.957 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.601 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 67.9 p -57.82 143.11 43.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 0.0 111.014 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.417 ' CD ' ' HG3' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -45.29 -47.58 13.03 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.667 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.62 -11.51 35.89 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.03 -20.69 13.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.957 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.466 ' CE2' ' HA2' ' A' ' 97' ' ' GLY . 2.1 m-85 -96.84 156.56 16.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.324 0.583 . . . . 0.0 112.026 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.476 ' CE1' ' HD3' ' A' ' 105' ' ' LYS . 2.7 t80 -43.72 96.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.991 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.452 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . 83.6 p -56.74 -26.17 56.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.155 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.476 ' HD3' ' CE1' ' A' ' 103' ' ' PHE . 0.1 OUTLIER -47.79 -51.57 22.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.727 0.298 . . . . 0.0 111.274 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.24 -24.14 3.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 104' ' ' SER . 14.6 mmtm 61.14 54.19 3.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.362 0.601 . . . . 0.0 109.728 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.0 mtp85 -124.68 -66.05 1.0 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.555 1.169 . . . . 0.0 108.63 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.44 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 15.1 m-85 -100.65 145.65 28.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 112.71 -2.041 . . . . 0.0 110.449 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -64.34 -10.03 21.7 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.7 p -151.65 154.18 35.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.574 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.9 p -61.55 -33.68 58.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.327 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -63.43 -41.77 98.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.106 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.44 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 63.9 m -62.51 -28.03 69.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -51.8 9.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.778 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 120' ' ' SER . 0.1 OUTLIER -68.16 -19.19 64.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.403 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 4.9 m -82.76 -47.09 12.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.95 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.26 -25.04 66.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.779 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.8 t -85.68 -54.56 4.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.476 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' SER . . . . . 0.422 ' HB2' ' O ' ' A' ' 116' ' ' ARG . 3.2 m -80.41 4.42 18.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.088 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 117' ' ' SER . 35.6 t30 . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.53 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.41 145.91 76.54 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.946 2.431 . . . . 0.0 112.782 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.79 126.5 51.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.321 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.8 126.28 41.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 111.314 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 116.49 17.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.259 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.29 -28.39 66.72 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.441 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.6 tpt -90.67 -58.23 2.55 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.431 ' HB2' HG12 ' A' ' 95' ' ' ILE . 10.3 m -83.94 -41.71 17.05 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.37 9.0 45.51 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.787 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.431 HG12 ' HB2' ' A' ' 93' ' ' CYS . 1.5 mm -56.17 179.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.4 ' H ' ' CG2' ' A' ' 95' ' ' ILE . 3.0 t -149.41 113.99 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.364 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.19 144.77 12.32 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.49 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 101' ' ' ALA . 4.6 p -62.75 138.71 58.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.409 ' C ' ' H ' ' A' ' 101' ' ' ALA . 1.9 ptm180 -31.43 -45.59 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -64.35 3.79 0.43 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 98' ' ' THR . . . -134.14 20.91 3.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.702 0.287 . . . . 0.0 110.914 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -132.06 155.28 48.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.022 0.439 . . . . 0.0 111.575 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.425 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.0 t80 -44.5 99.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.935 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.53 -27.18 15.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.927 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.425 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 6.8 tptp -47.8 -59.29 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 111.022 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.1 p -122.48 -33.96 3.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.94 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.18 -4.59 2.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.445 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 21.8 mtp180 -83.88 -24.97 30.6 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.854 0.359 . . . . 0.0 110.757 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -126.93 138.91 53.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.37 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.4 p -63.16 -12.95 31.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -156.25 159.14 38.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.81 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.31 -33.41 63.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 178.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 t -57.54 -41.76 81.6 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.327 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.87 -21.26 63.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.308 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.8 t -79.88 -51.67 8.84 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.135 0.493 . . . . 0.0 110.143 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -67.79 -17.47 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.4 t -82.38 -52.37 6.97 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.686 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.42 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 5.6 t80 -60.32 -22.88 63.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.704 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.28 -43.4 11.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.205 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 38.7 m -82.85 -54.63 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 . . . . . 0 C--N 1.331 -0.235 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.414 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.6 mt-10 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.476 0.179 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 4.6 Cg_exo -74.46 148.15 37.49 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.703 2.269 . . . . 0.0 112.215 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.458 ' O ' ' CZ ' ' A' ' 102' ' ' PHE . . . -143.02 136.22 28.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.227 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 95' ' ' ILE . 17.0 t -90.9 133.8 31.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 20.3 t -64.9 124.82 23.01 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.457 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -69.52 3.83 2.16 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -118.41 -52.17 2.38 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.577 0.703 . . . . 0.0 109.862 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.452 ' HB2' HG12 ' A' ' 95' ' ' ILE . 5.9 m -96.9 -48.28 5.5 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.862 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.405 ' HA3' HG11 ' A' ' 89' ' ' VAL . . . 111.8 6.58 24.63 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -176.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.452 HG12 ' HB2' ' A' ' 93' ' ' CYS . 2.1 mm -52.18 -177.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.426 ' H ' ' CG2' ' A' ' 95' ' ' ILE . 2.5 t -138.53 136.11 43.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.265 0.555 . . . . 0.0 111.17 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.25 162.29 29.45 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.76 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.2 p -73.48 148.38 43.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.519 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -47.14 -31.05 3.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.467 -178.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 99' ' ' ARG . 26.6 mt-10 -85.95 -38.82 17.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.94 -23.76 63.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.674 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.49 ' HB3' ' HA ' ' A' ' 107' ' ' LYS . 6.9 m-85 -72.72 161.18 31.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.075 0.464 . . . . 0.0 111.822 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 105' ' ' LYS . 6.4 t80 -58.44 102.21 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.211 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.404 ' HA ' ' NZ ' ' A' ' 107' ' ' LYS . 77.3 p -38.99 -29.48 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.085 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 21.9 tttt -50.04 -60.7 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.0 p -128.21 -24.44 3.13 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 70.19 21.58 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.678 0.275 . . . . 0.0 111.06 -179.473 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -110.46 -9.44 14.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.56 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.436 ' CD1' ' CB ' ' A' ' 115' ' ' SER . 35.5 m-85 -128.93 151.39 49.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.745 0.307 . . . . 0.0 110.854 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 4.0 p -61.26 -27.16 68.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 p -160.48 157.6 27.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.968 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.429 ' HA ' ' CD2' ' A' ' 103' ' ' PHE . 10.9 p -53.18 -31.49 17.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.014 0.435 . . . . 0.0 110.332 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.403 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 25.0 p -68.03 -47.79 67.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.44 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.58 -43.4 84.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.927 0.394 . . . . 0.0 110.254 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.436 ' CB ' ' CD1' ' A' ' 109' ' ' PHE . 47.1 p -57.25 -61.12 2.69 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.594 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' A' ' 113' ' ' SER . 10.9 ptm180 -54.39 -25.74 26.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.108 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.31 -61.92 1.62 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.277 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.533 ' O ' ' HD1' ' A' ' 118' ' ' TYR . 0.9 OUTLIER -46.26 -43.94 15.99 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.094 0.473 . . . . 0.0 111.61 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.3 t -69.51 -53.73 17.68 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.693 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.7 m -69.07 0.16 5.0 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.644 0.259 . . . . 0.0 111.103 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.422 0.153 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.36 160.22 46.44 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.401 2.067 . . . . 0.0 112.423 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -136.47 141.45 43.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.216 179.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.46 126.38 67.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.848 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 50.5 t -86.57 85.52 7.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.369 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.447 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 6.7 mm-40 -46.21 -20.69 0.11 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -178.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.497 ' HB2' ' HB2' ' A' ' 118' ' ' TYR . 0.4 OUTLIER -82.95 -58.7 2.75 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.004 0.431 . . . . 0.0 111.325 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.0 m -88.99 -56.93 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.09 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 126.89 -10.37 7.06 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 3.9 mt -52.2 155.37 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 88' ' ' ALA . 46.4 t -147.58 125.16 3.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.856 0.36 . . . . 0.0 111.67 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -145.04 -167.8 12.45 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.92 128.46 36.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.48 0.64 . . . . 0.0 111.072 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.423 ' C ' ' H ' ' A' ' 101' ' ' ALA . 5.7 mtt180 -33.8 -66.12 0.17 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.311 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -47.31 -6.89 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.423 ' H ' ' C ' ' A' ' 99' ' ' ARG . . . -94.96 -50.32 5.16 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.81 179.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -51.46 172.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.428 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.0 t80 -55.01 110.16 0.63 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.921 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.6 p -68.45 -24.84 64.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.4 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.428 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 4.5 mttt -55.58 -55.44 31.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.255 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.7 -37.43 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.107 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.29 10.77 7.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.343 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.401 ' O ' ' CD1' ' A' ' 109' ' ' PHE . 37.3 mtm180 -113.48 -3.62 13.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.444 ' CE1' ' HD1' ' A' ' 118' ' ' TYR . 40.6 m-85 -147.33 161.77 40.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.226 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 7.1 p -85.5 24.33 1.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.8 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER 174.15 -175.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.574 0.702 . . . . 0.0 112.409 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.444 ' N ' ' OG ' ' A' ' 111' ' ' SER . 7.1 p -91.24 -54.51 7.34 Favored 'Isoleucine or valine' 0 C--O 1.25 1.104 0 CA-C-N 114.7 -1.136 . . . . 0.0 109.953 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.421 ' O ' ' CB ' ' A' ' 117' ' ' SER . 3.9 p -66.32 -27.41 67.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.493 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.2 t -63.47 -37.81 88.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.769 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.3 t -67.83 -67.19 0.48 Allowed 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -21.1 12.2 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.545 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 113' ' ' SER . 4.2 m -73.54 -58.33 3.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.497 ' HB2' ' HB2' ' A' ' 92' ' ' MET . 8.4 t80 -48.22 -35.22 11.48 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.4 t -84.45 -62.65 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.421 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.4 m -58.43 -54.98 40.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.56 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.9 t30 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.08 -179.721 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA3' ' CG ' ' A' ' 86' ' ' GLU . . . . . . . . 0 N--CA 1.488 2.147 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.81 -83.2 0.36 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.606 0.241 . . . . 0.0 111.371 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.48 -70.64 0.99 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.59 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.39 69.48 0.09 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.994 0.426 . . . . 0.0 110.65 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.406 ' CG ' ' HA3' ' A' ' 82' ' ' GLY . 4.8 mm-40 -54.29 140.95 53.55 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.998 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 97.3 Cg_endo -84.81 132.33 4.73 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.624 2.216 . . . . 0.0 112.775 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.23 102.17 8.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.48 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.0 t -79.08 138.28 20.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.788 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -84.2 120.48 26.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.539 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -69.19 -20.54 63.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.838 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.5 -58.26 2.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.44 -29.68 16.91 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.39 -19.49 53.63 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.574 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.7 mt -54.44 134.36 17.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.815 0.34 . . . . 0.0 111.449 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.8 t -114.93 141.71 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.402 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.48 -173.4 20.62 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.978 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 p -89.78 142.65 27.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.75 -42.56 5.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -1.84 16.66 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.41 -28.02 7.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.317 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 0.8 OUTLIER -87.56 160.41 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 111.451 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.93 110.43 0.23 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.347 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.2 m -62.58 -27.31 69.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.397 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 1.1 ttmt -50.76 -60.28 3.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.801 0.334 . . . . 0.0 111.166 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.408 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.6 p -116.96 -40.37 3.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.71 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 82.93 -21.6 0.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.653 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -68.22 -32.38 72.55 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -119.49 142.97 47.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -66.26 -11.22 48.94 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -152.85 155.27 36.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.887 0.375 . . . . 0.0 111.662 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.424 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -63.22 -34.06 64.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.065 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 82.5 p -58.94 -44.31 91.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.926 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.9 m -58.69 -24.6 61.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.534 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.82 -50.75 10.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.797 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -69.36 -19.28 63.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.407 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.4 m -82.1 -51.51 7.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.082 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.0 -26.0 68.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.85 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.37 -46.11 9.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.307 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.02 0.7 54.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.277 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -134.39 0.45 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.13 -168.82 1.5 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.147 0.498 . . . . 0.0 111.735 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -162.93 150.79 13.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.926 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.896 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.445 -0.262 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.9 p -49.74 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.781 0.324 . . . . 0.0 111.177 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 47.61 -109.93 0.53 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.745 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.59 45.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.897 0.379 . . . . 0.0 110.841 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -57.47 116.93 15.47 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.017 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.38 136.81 37.99 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.58 2.186 . . . . 0.0 112.43 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.97 116.31 22.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.876 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -81.49 136.53 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.534 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -80.07 119.86 23.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.271 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.35 -22.6 66.83 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 2.9 tpt -91.21 -58.26 2.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.06 -29.83 19.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 98.41 -22.04 42.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.266 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.5 mm -54.79 136.34 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.961 0.41 . . . . 0.0 111.085 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.5 t -108.03 139.9 28.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.889 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.467 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.7 158.52 27.72 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.299 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.2 p -68.99 143.68 54.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.83 0.315 . . . . 0.0 110.399 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -44.84 -41.92 7.47 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.91 -4.37 27.87 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.92 -27.32 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.303 . . . . 0.0 111.122 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.467 ' CE2' ' HA2' ' A' ' 97' ' ' GLY . 1.4 m-85 -88.28 158.95 18.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.26 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.82 118.57 1.66 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.205 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 26.7 t -65.52 -27.0 68.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.542 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.455 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 16.4 tptp -52.32 -49.07 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 7.4 p -128.12 -42.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.335 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 106' ' ' THR . 22.9 mmtm 84.79 -20.88 0.27 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.455 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -75.33 -25.0 57.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.866 0.365 . . . . 0.0 110.616 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.41 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 45.6 m-85 -120.75 133.34 55.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.175 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.5 p -63.02 -12.75 28.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -151.62 153.78 35.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.004 0.43 . . . . 0.0 111.884 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.43 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.0 p -60.95 -35.49 65.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.045 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.5 t -59.62 -40.77 88.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.773 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.41 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 8.5 m -60.8 -27.66 68.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.224 179.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 t -74.73 -53.82 8.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.878 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -70.55 -17.58 62.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.59 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.1 m -81.83 -49.24 10.6 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.419 ' CE2' ' O ' ' A' ' 124' ' ' LYS . 1.2 t80 -67.6 -25.25 65.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.778 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -83.93 -50.85 7.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.246 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.0 t -61.15 -51.43 69.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.18 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -88.76 -69.94 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.671 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 68.14 18.34 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.99 4.19 45.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.686 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.419 ' O ' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.901 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.15 -70.75 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 111.067 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 61.92 69.76 1.22 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.529 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m 47.37 60.15 3.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.791 0.329 . . . . 0.0 111.401 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.23 142.03 86.54 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.201 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.33 131.3 3.53 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.887 2.392 . . . . 0.0 112.759 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -116.78 106.65 13.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.906 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.7 t -82.06 126.31 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.416 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.33 122.45 22.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.414 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -66.3 -22.15 66.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.78 -58.23 2.55 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 m -86.13 -33.39 20.9 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.18 16.91 54.95 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.425 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.72 132.87 34.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.423 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -108.77 135.93 46.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.382 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.36 171.49 30.24 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.288 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 39.0 p -72.45 137.6 46.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.573 0.225 . . . . 0.0 110.581 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -43.27 -40.94 3.72 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.27 0.23 6.79 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -118.97 -19.15 8.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.646 0.26 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.439 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.5 m-85 -93.38 158.84 15.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.154 0.502 . . . . 0.0 111.745 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.444 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.7 t80 -44.63 111.68 0.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.32 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 69.6 m -64.26 -31.16 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.426 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.444 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -49.63 -57.29 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.221 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -113.79 -46.1 3.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 85.33 -26.09 0.11 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.424 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 14.1 mtm180 -69.86 -32.99 71.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.875 0.369 . . . . 0.0 110.597 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -118.25 138.48 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.437 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.439 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 29.5 p -63.12 -13.73 40.04 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.7 p -150.55 152.96 34.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.975 0.417 . . . . 0.0 111.739 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.3 p -62.79 -33.75 61.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.991 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 8.0 t -60.7 -37.97 83.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.803 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 58.1 m -62.87 -24.7 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.162 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -50.24 10.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -70.53 -19.52 62.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.398 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 11.3 t -80.98 -51.17 8.82 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.802 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -63.69 -26.01 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.65 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.47 -43.36 11.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.438 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -87.56 -0.34 56.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.395 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 -138.7 2.07 2.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.8 171.57 19.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 111.894 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -171.74 153.76 3.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.995 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.868 179.802 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 t -162.36 141.43 9.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 110.892 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.6 -89.84 0.94 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.516 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.0 p -157.35 60.35 0.5 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.937 0.398 . . . . 0.0 110.795 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -55.53 143.2 58.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.182 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.2 Cg_endo -86.53 131.15 3.38 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.885 2.39 . . . . 0.0 112.88 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.425 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -108.89 164.63 12.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.787 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 20.7 t -138.13 126.28 30.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.498 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -73.85 108.88 6.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.076 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.26 -19.18 7.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.304 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.2 tpt -100.29 -58.68 1.85 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.83 -30.89 40.52 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 94.09 -21.0 44.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.454 -0.879 . . . . 0.0 112.431 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 33.5 mm -52.49 133.71 14.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.528 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.425 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 16.4 t -110.43 140.86 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.252 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.33 -167.79 14.74 Favored Glycine 0 C--O 1.227 -0.298 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.802 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 70.4 p -98.38 142.16 30.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.969 0.384 . . . . 0.0 110.339 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.65 -42.53 7.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.08 -1.13 16.12 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.06 -31.29 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.862 0.363 . . . . 0.0 111.091 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -81.26 161.12 24.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.334 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 1.2 t80 -44.69 118.08 1.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.139 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.8 m -71.95 -29.27 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.588 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 19.5 tptp -57.84 -38.71 76.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.43 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.561 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 44.1 p -128.21 -48.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 106' ' ' THR . 11.6 mmtp 84.09 -31.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 55.9 mtm180 -62.09 -46.99 86.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.837 0.351 . . . . 0.0 110.28 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -105.17 143.28 33.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.474 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.417 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 30.7 p -66.72 -11.01 52.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -154.06 156.44 37.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.938 0.399 . . . . 0.0 111.689 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.437 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.8 p -64.93 -33.73 65.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.91 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -45.47 86.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.838 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 95.4 m -59.33 -24.48 63.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.334 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.6 t -76.1 -50.17 15.39 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.726 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -21.54 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.491 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -49.27 12.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.886 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -65.87 -25.88 67.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.873 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.0 p -88.01 -40.06 14.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.132 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 1.1 t -90.43 -4.09 57.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.845 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -140.36 35.55 1.87 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.684 0.278 . . . . 0.0 111.3 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.98 -39.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.147 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -73.12 -64.13 1.04 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.865 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.852 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.441 ' O ' ' CB ' ' A' ' 83' ' ' SER . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 82' ' ' GLY . 4.6 t 84.57 -65.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.728 0.299 . . . . 0.0 110.934 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 53.32 62.05 6.38 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.824 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 m 54.1 48.22 21.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.787 0.327 . . . . 0.0 111.301 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 0.3 OUTLIER -54.85 129.46 65.22 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_exo -65.06 126.45 16.49 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.551 2.167 . . . . 0.0 112.697 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -118.0 102.51 9.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.783 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 t -79.24 132.74 31.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.432 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 32.2 t -80.41 121.7 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.582 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -69.39 -20.2 63.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.775 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 7.8 tpt -89.52 -58.2 2.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 6.6 m -89.15 -31.7 17.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.09 17.96 51.82 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.523 -0.846 . . . . 0.0 112.473 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mm -91.77 134.05 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.384 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.2 t -109.92 137.51 41.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.182 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.54 -178.05 25.04 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.983 179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.7 p -81.87 136.74 35.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.789 0.294 . . . . 0.0 110.249 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mtp180 -43.2 -38.42 2.5 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.64 3.83 3.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.17 -21.05 6.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.688 0.28 . . . . 0.0 111.435 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.442 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.8 m-85 -91.07 160.71 15.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.09 0.471 . . . . 0.0 111.504 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.48 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.57 108.23 0.11 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.096 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 t -57.54 -42.54 83.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.842 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.48 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 2.8 mmpp? -46.5 -60.29 2.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.45 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -102.52 -52.41 3.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.048 -179.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.454 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 86.57 -27.31 0.08 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.507 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.94 -32.57 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.9 0.381 . . . . 0.0 110.72 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -117.4 144.41 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.644 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.3 p -66.08 -11.36 48.15 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.9 p -154.87 157.38 37.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.902 0.382 . . . . 0.0 111.644 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.4 p -65.29 -34.77 72.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.978 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.3 p -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.736 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.71 -22.04 63.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.389 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.88 -48.39 11.59 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -70.72 -20.59 62.64 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 5.0 t -78.95 -50.7 10.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.447 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 1.9 t80 -63.95 -24.17 67.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.529 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.5 p -88.19 -34.39 17.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.805 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 66.4 m -93.81 -6.17 46.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.013 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 58.6 m-80 -137.3 13.57 3.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.447 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -152.6 120.69 6.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.994 0.426 . . . . 0.0 111.202 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 176.9 158.74 0.34 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.798 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.62 -172.88 0.23 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 0.0 110.817 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.04 -85.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.404 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 50.19 1.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 0.0 110.84 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.67 141.1 46.77 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.155 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -85.73 131.58 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.791 2.327 . . . . 0.0 112.792 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.81 99.52 7.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.416 ' CG1' HG21 ' A' ' 96' ' ' VAL . 38.5 t -79.08 126.27 38.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.434 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.16 115.22 10.05 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -71.59 -21.24 61.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.704 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -13.26 23.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.441 ' CB ' HD13 ' A' ' 95' ' ' ILE . 55.8 m -132.05 -43.69 0.96 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 118.131 0.423 . . . . 0.0 111.666 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 119.35 -32.48 5.05 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.441 HD13 ' CB ' ' A' ' 93' ' ' CYS . 2.5 mp -52.54 132.33 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.84 0.352 . . . . 0.0 111.855 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.416 HG21 ' CG1' ' A' ' 89' ' ' VAL . 10.9 t -115.55 141.77 31.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.704 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.43 -176.73 23.71 Favored Glycine 0 C--O 1.228 -0.273 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.116 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.9 p -86.99 142.19 28.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.791 0.296 . . . . 0.0 110.292 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.53 -41.56 2.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.95 -1.58 10.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.04 -17.62 8.95 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.412 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 2.2 m-85 -97.2 159.05 15.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.022 0.439 . . . . 0.0 111.669 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.461 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 4.7 t80 -44.93 113.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.9 t -59.91 -39.53 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.776 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.461 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -46.68 -60.31 2.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.81 0.338 . . . . 0.0 111.568 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.435 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 22.5 p -106.61 -52.16 2.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 84.77 -23.07 0.18 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.461 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.0 -27.93 60.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.686 0.279 . . . . 0.0 110.922 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -119.52 137.41 53.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.465 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 26.9 p -57.68 -15.01 6.49 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.0 p -152.24 154.56 36.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.997 0.427 . . . . 0.0 112.001 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.445 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -63.26 -35.82 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.023 178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.6 p -57.85 -38.97 76.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.614 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.9 m -60.93 -24.41 66.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.347 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 -51.14 10.01 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 ptp85 -70.36 -17.58 63.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.321 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 122' ' ' SER . 2.3 m -83.94 -50.06 8.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.14 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.85 -24.04 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.864 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.1 t -88.11 -49.34 7.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.931 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 2.0 t -77.9 -58.31 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.995 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -93.28 -81.14 0.37 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 117' ' ' SER . 0.2 OUTLIER 167.86 -173.57 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.579 -179.665 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -61.88 -89.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.767 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.911 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.461 -0.256 . . . . 0.0 112.461 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.404 ' O ' ' N ' ' A' ' 85' ' ' SER . 3.0 p -126.02 138.1 53.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 111.165 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.65 77.71 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.388 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.438 ' N ' ' HD3' ' A' ' 99' ' ' ARG . 16.3 t 172.04 39.28 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.007 0.432 . . . . 0.0 109.998 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -96.51 161.99 24.91 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.231 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.27 135.21 22.22 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.019 2.479 . . . . 0.0 112.613 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.57 123.02 39.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.638 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.7 t -80.31 144.19 11.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.67 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 48.7 t -90.06 119.79 30.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.476 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -64.23 -23.52 67.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -91.61 -58.17 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.0 -29.33 19.57 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.77 -23.18 37.11 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.978 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.6 mm -53.9 137.12 14.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.933 0.397 . . . . 0.0 111.059 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.2 t -108.53 138.44 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.704 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.72 150.86 22.92 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.086 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.0 p -57.61 138.62 55.11 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.438 ' HD3' ' N ' ' A' ' 85' ' ' SER . 2.6 ptm180 -46.52 -36.52 6.82 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -70.26 0.67 5.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.55 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.58 -19.41 7.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.318 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -92.08 158.07 16.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.439 ' CZ ' ' HB ' ' A' ' 112' ' ' VAL . 2.2 t80 -45.2 115.35 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.113 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 33.4 p -62.8 -28.9 70.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.555 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.434 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -54.12 -60.5 3.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 0.0 111.187 -179.602 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.442 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.6 OUTLIER -107.34 -46.25 3.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.078 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.97 -26.68 0.1 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.515 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 7.5 mtm-85 -71.97 -23.05 61.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -121.58 140.72 51.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.6 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.2 p -66.94 -12.14 58.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.46 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.5 p -152.91 154.85 35.88 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.441 . . . . 0.0 112.059 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -62.91 -35.57 71.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.911 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.2 p -58.21 -40.63 82.13 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.792 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.56 -24.53 65.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.406 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -79.91 -49.36 12.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -20.66 62.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.408 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 5.6 m -80.25 -52.02 8.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.782 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.481 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 1.4 t80 -63.7 -25.89 68.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.715 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -88.69 -42.86 11.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.429 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.6 t -88.71 -2.02 58.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.247 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -139.82 0.95 1.84 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.481 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -148.78 153.52 38.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.141 0.496 . . . . 0.0 111.664 -179.811 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt 51.39 70.67 0.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.87 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.0 t 67.41 153.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.795 0.331 . . . . 0.0 110.829 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.35 21.69 31.54 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.542 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.1 p -145.0 46.15 1.34 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.877 0.37 . . . . 0.0 110.639 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.11 116.95 25.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.919 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -61.52 133.03 43.53 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.51 2.14 . . . . 0.0 112.442 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -121.84 114.24 20.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.7 t -78.99 135.27 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.432 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 38.6 t -80.97 120.18 24.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.744 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.442 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -67.43 -21.39 65.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.971 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -58.32 2.53 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.3 m -90.85 -27.72 18.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.46 -19.91 52.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.485 -0.865 . . . . 0.0 112.146 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.3 mm -57.76 142.16 13.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.987 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.3 t -115.67 142.91 26.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.952 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.426 ' HA2' ' CE1' ' A' ' 102' ' ' PHE . . . -150.34 161.03 28.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.112 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 71.1 p -69.26 140.11 54.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.416 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 12.5 ptm180 -41.58 -41.25 2.11 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -71.31 0.66 7.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.94 -21.15 6.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.577 0.227 . . . . 0.0 111.594 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.426 ' CE1' ' HA2' ' A' ' 97' ' ' GLY . 1.4 m-85 -92.64 161.25 14.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.933 0.397 . . . . 0.0 111.33 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 3.3 t80 -44.65 100.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.082 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.407 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 52.9 m -55.98 -25.01 42.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.731 -179.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 1.1 tptp -54.4 -59.83 4.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 111.044 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.437 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.0 OUTLIER -117.19 -40.64 3.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.84 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.437 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 84.32 -17.52 0.46 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.663 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -61.68 -46.09 91.23 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.781 0.324 . . . . 0.0 110.588 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.457 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 9.0 m-85 -108.44 160.26 16.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.55 -5.78 49.09 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -161.6 164.33 29.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.098 0.475 . . . . 0.0 112.062 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.435 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -66.6 -44.58 89.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.299 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 p -57.94 -36.11 72.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.853 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -67.23 -18.96 65.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.498 178.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 7.0 p -85.88 -46.73 10.32 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.623 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -74.78 -20.74 59.68 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 39.6 m -81.32 -53.63 6.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.52 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 15.7 t80 -67.15 -20.06 65.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.149 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -88.23 -49.86 6.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.203 0.525 . . . . 0.0 110.894 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 t -80.22 6.3 12.21 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.761 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.2 m-80 -101.2 12.78 36.91 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.825 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.1 t 58.76 77.76 0.29 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.824 0.345 . . . . 0.0 110.784 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -64.88 -76.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.909 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.3 tttm . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.963 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.4 163.89 1.64 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 69.19 71.56 0.97 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.532 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 p 42.94 68.95 0.43 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.765 0.317 . . . . 0.0 111.671 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -60.17 142.94 89.31 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.757 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.9 Cg_endo -82.25 128.62 5.66 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.76 2.307 . . . . 0.0 113.277 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -106.5 169.85 8.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.814 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -139.29 126.32 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.84 0.352 . . . . 0.0 111.908 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 35.5 t -78.51 114.63 17.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.399 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -63.68 -18.63 64.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.244 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.5 tpt -94.38 -58.37 2.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.7 m -88.18 -25.37 22.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.13 22.13 61.54 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.385 -0.912 . . . . 0.0 112.24 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.9 mm -89.69 128.45 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.79 0.328 . . . . 0.0 110.479 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.445 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 6.1 t -103.65 134.56 44.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.407 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.15 -169.1 15.89 Favored Glycine 0 C--O 1.228 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.122 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.7 p -95.3 137.25 34.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.4 ' HG2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -43.58 -40.46 4.04 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.8 3.39 8.15 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.02 -28.61 4.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 111.436 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.438 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 0.4 OUTLIER -79.09 161.53 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 111.82 -179.407 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.439 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.3 t80 -44.67 106.4 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.237 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 47.5 m -62.94 -25.43 68.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.536 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.439 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -51.49 -60.39 3.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.778 0.323 . . . . 0.0 111.139 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.441 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.2 p -113.5 -36.76 4.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.441 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.57 -34.25 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.494 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.59 -51.06 68.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.819 0.342 . . . . 0.0 110.685 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -101.93 140.71 35.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.652 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.438 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 31.3 p -64.18 -14.45 55.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 112.31 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.1 p -151.67 154.22 35.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.842 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -63.16 -32.77 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.746 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 116' ' ' ARG . 4.2 t -57.74 -44.69 86.21 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.741 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 65.2 m -59.65 -27.67 66.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.171 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 t -72.12 -55.29 7.56 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.978 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -69.28 -18.1 63.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.907 0.384 . . . . 0.0 110.122 178.816 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 1.8 m -79.55 -54.02 6.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -61.17 -24.77 66.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.079 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.8 t -83.23 -52.93 6.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.512 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -50.9 8.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 37.8 t30 -67.15 -5.16 12.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 49.7 m 50.44 87.14 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.65 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.442 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.2 tttt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.913 -179.851 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -148.16 -70.02 0.22 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.731 0.301 . . . . 0.0 111.502 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -45.09 -72.25 0.39 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.221 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -174.69 78.22 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.843 0.354 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 3.5 mm-40 -50.9 134.84 28.29 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.374 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 6.2 Cg_exo -77.86 131.54 11.22 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.359 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -120.35 98.93 6.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.69 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.6 t -79.74 133.76 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.249 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -78.08 118.66 20.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.646 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.485 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 7.1 mm-40 -65.79 -20.51 66.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.852 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -58.23 2.47 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.7 m -88.58 -31.89 18.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.05 19.28 43.42 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.865 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 3.2 mp -89.96 128.39 41.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.116 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.71 137.3 32.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.253 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.51 -174.96 22.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.766 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 p -90.49 143.17 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.952 0.376 . . . . 0.0 110.333 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -43.96 -42.23 5.8 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -71.67 0.01 9.79 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.91 -28.27 7.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 111.321 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.41 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 1.5 m-85 -87.96 160.08 18.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.2 t80 -44.98 105.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.4 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.4 p -57.43 -26.4 61.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.435 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -53.62 -60.04 3.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.163 -179.795 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.431 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.3 p -115.1 -43.55 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 83.57 -21.32 0.28 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.498 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -67.69 -34.07 76.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.74 0.305 . . . . 0.0 110.834 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.486 ' CE2' ' CD2' ' A' ' 118' ' ' TYR . 19.2 m-85 -118.42 148.22 42.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.502 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.41 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 14.9 p -66.83 -7.6 22.72 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.4 p -163.31 166.16 23.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.928 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.66 -46.19 86.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.453 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.5 p -56.99 -39.69 75.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.14 0.495 . . . . 0.0 109.815 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.6 t -63.71 -18.91 64.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.478 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.1 t -85.56 -47.17 10.13 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -73.24 -19.73 61.01 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 8.4 t -82.19 -53.38 6.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.476 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.486 ' CD2' ' CE2' ' A' ' 109' ' ' PHE . 14.4 t80 -65.19 -20.45 66.45 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.141 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.4 t -87.99 -50.37 6.46 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.488 . . . . 0.0 110.632 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.3 m -81.48 3.61 24.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.071 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 117' ' ' SER . 0.8 OUTLIER -89.36 -1.11 57.94 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 54.99 77.31 0.22 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.907 0.384 . . . . 0.0 110.812 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -63.6 -46.33 86.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.174 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.009 -179.83 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -168.1 149.91 5.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.881 0.372 . . . . 0.0 110.947 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.96 -177.91 38.85 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.982 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 77.36 -34.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -47.59 128.3 10.65 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.93 136.9 3.74 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.979 2.452 . . . . 0.0 112.427 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.73 108.25 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 9.8 t -81.62 128.08 39.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -75.43 120.43 20.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.535 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.434 ' HG2' ' CE1' ' A' ' 118' ' ' TYR . 1.5 tt0 -68.28 -17.77 64.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.719 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 9.6 tpt -92.62 -58.14 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.9 m -88.18 -31.99 18.83 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 -178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.73 19.01 49.87 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.254 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -93.82 132.98 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 120.951 0.405 . . . . 0.0 110.063 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -105.04 133.47 49.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.387 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.57 151.59 23.59 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.833 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.6 p -59.14 140.31 56.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.019 0.41 . . . . 0.0 110.604 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.405 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 32.2 ptt85 -44.56 -33.9 1.93 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.24 -0.436 . . . . 0.0 112.007 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -68.13 -2.9 8.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.07 -1.13 7.77 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -109.55 158.06 18.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.178 0.513 . . . . 0.0 111.73 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.9 t80 -44.43 100.59 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.178 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.4 OUTLIER -49.87 -28.39 6.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.884 -179.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.454 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -50.44 -54.64 20.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.848 0.356 . . . . 0.0 111.216 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 2.1 p -128.01 -38.01 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.147 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 8.3 mmtp 81.27 -9.52 1.29 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.535 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -68.85 -34.29 75.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.601 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -118.35 143.74 46.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.1 p -63.7 -13.09 40.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -155.8 158.27 37.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.988 0.423 . . . . 0.0 111.907 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.4 p -65.73 -36.06 76.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.837 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -58.15 -39.2 78.2 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.568 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.67 -21.58 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.367 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.6 p -82.34 -48.41 11.19 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.673 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -71.95 -19.68 61.86 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.422 ' O ' ' N ' ' A' ' 121' ' ' ASN . 4.0 m -79.06 -51.88 8.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 122' ' ' SER . 1.9 t80 -63.56 -23.58 67.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.554 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 16.6 p -88.37 -35.74 16.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.739 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -92.59 -6.16 50.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.981 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 117' ' ' SER . 71.3 m-80 -134.64 5.34 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.441 ' HB3' ' CD2' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -145.78 129.63 17.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.913 0.387 . . . . 0.0 111.027 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.23 146.14 30.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.875 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.862 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -76.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 58.25 -148.46 36.98 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.539 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.7 p -134.02 46.91 2.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 0.0 110.771 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.13 146.75 33.32 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HB2' ' CG1' ' A' ' 96' ' ' VAL . 92.2 Cg_endo -85.24 149.47 10.48 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.865 2.377 . . . . 0.0 112.546 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.71 120.9 33.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.0 t -79.11 137.74 21.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.624 -179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 39.0 t -81.16 114.9 20.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.96 -22.1 62.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -95.9 -58.31 2.13 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.409 ' CB ' ' CD1' ' A' ' 95' ' ' ILE . 4.4 m -89.29 -28.98 19.51 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.12 -24.32 32.32 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.474 -179.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.409 ' CD1' ' CB ' ' A' ' 93' ' ' CYS . 4.5 mp -52.71 138.1 11.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.914 0.388 . . . . 0.0 111.01 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.403 ' CG1' ' HB2' ' A' ' 87' ' ' PRO . 8.7 t -113.33 141.3 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.666 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.411 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.73 156.12 26.52 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.116 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.6 p -65.8 142.71 57.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.514 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -44.41 -34.96 2.2 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.449 ' N ' ' HG2' ' A' ' 99' ' ' ARG . 2.7 tp10 -74.17 -0.68 17.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.24 -18.9 7.25 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.411 ' CE2' ' HA2' ' A' ' 97' ' ' GLY . 1.5 m-85 -91.97 161.38 14.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.7 97.28 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.203 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.421 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 9.0 t -47.74 -28.88 2.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.064 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 0.8 OUTLIER -54.43 -60.42 3.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 p -119.64 -39.25 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 81.64 -14.15 0.82 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.719 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -64.19 -39.34 93.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.758 0.313 . . . . 0.0 110.549 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.429 ' CD1' ' HA ' ' A' ' 115' ' ' SER . 11.5 m-85 -112.07 153.51 26.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.386 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.5 p -68.39 -7.69 33.72 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -165.53 168.41 16.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.051 0.453 . . . . 0.0 111.94 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.42 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -68.12 -43.27 85.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.237 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.6 t -57.66 -40.61 79.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.8 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.34 -19.06 65.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.563 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.429 ' HA ' ' CD1' ' A' ' 109' ' ' PHE . 4.9 p -84.29 -45.35 12.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.53 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -74.21 -19.84 60.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.848 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 3.8 t -80.81 -53.88 6.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.584 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -66.72 -22.39 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.999 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 t -88.31 -48.78 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.917 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.6 m -81.12 2.88 25.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.146 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 117' ' ' SER . 58.1 m-80 -140.16 -0.2 1.66 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.94 155.58 43.5 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.871 0.367 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.02 146.17 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.931 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.291 -0.861 . . . . 0.0 111.017 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 112.584 -0.207 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -75.11 -76.62 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.881 0.372 . . . . 0.0 110.758 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.89 129.14 1.88 Allowed Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.4 t 63.06 50.44 3.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.143 0.497 . . . . 0.0 109.689 -178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.12 162.33 75.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.448 -179.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.94 128.42 3.75 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.857 2.371 . . . . 0.0 112.79 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.442 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -110.02 167.3 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.571 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.1 t -137.95 126.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.591 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.73 110.53 8.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.476 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 6.5 mp0 -58.38 -21.13 49.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.2 tpt -96.9 -58.52 2.01 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -82.96 -27.85 30.2 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.6 20.89 60.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.095 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -88.72 129.07 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.442 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 6.0 t -104.93 136.35 38.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 111.328 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.43 -169.68 16.73 Favored Glycine 0 C--O 1.227 -0.289 0 N-CA-C 111.736 -0.546 . . . . 0.0 111.736 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.6 p -91.43 136.65 32.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.083 0.441 . . . . 0.0 110.137 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.455 ' HA ' ' CE ' ' A' ' 107' ' ' LYS . 20.7 mtp85 -42.9 -38.43 2.19 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.66 9.19 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.76 -34.66 4.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.999 0.428 . . . . 0.0 110.856 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -74.09 161.4 30.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 112.075 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.452 ' O ' ' HA ' ' A' ' 107' ' ' LYS . 4.6 t80 -44.34 152.16 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.886 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.1 m -96.16 -46.2 6.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.315 . . . . 0.0 111.559 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.442 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -47.8 -49.52 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -179.299 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.404 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 74.1 p -105.29 -49.0 3.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.33 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.455 ' CE ' ' HA ' ' A' ' 99' ' ' ARG . 0.1 OUTLIER 82.95 -46.73 0.14 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.157 -179.632 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -60.88 -45.28 95.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.984 0.421 . . . . 0.0 110.487 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -96.88 145.38 25.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -68.73 -9.65 51.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -155.96 158.41 37.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.956 0.408 . . . . 0.0 111.757 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.442 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.0 p -63.96 -36.48 76.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.896 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.4 t -57.27 -44.05 83.63 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.731 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.7 m -60.0 -26.13 65.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.017 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 p -73.46 -52.21 14.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -69.55 -20.81 63.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.245 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.85 -53.1 7.44 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.996 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.8 t80 -63.74 -25.15 68.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.987 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.5 t -81.26 -55.48 4.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.6 m -79.44 -52.42 8.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.47 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.17 -0.86 20.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.737 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 m 56.5 -158.91 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.711 0.291 . . . . 0.0 111.346 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.408 ' HD2' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -125.99 110.48 13.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.897 -179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.5 tptt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.941 179.894 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 97.4 p -50.86 -69.15 0.12 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.724 0.297 . . . . 0.0 111.574 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -101.68 71.32 0.37 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.361 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 46.87 59.32 4.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.924 0.393 . . . . 0.0 111.483 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -65.97 122.61 81.91 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.053 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.27 129.69 29.35 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.46 2.107 . . . . 0.0 112.661 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.93 109.7 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.615 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.3 t -82.29 131.71 33.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.834 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.402 ' O ' ' HA3' ' A' ' 94' ' ' GLY . 45.1 t -79.43 119.81 22.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.44 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.473 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.2 mt-10 -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.1 tpt -88.52 -58.26 2.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 11.7 m -86.96 -35.6 18.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.679 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 90' ' ' CYS . . . 103.99 -26.45 23.09 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.102 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -52.61 132.6 14.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 111.229 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 t -106.67 139.05 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.242 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.456 ' HA2' ' CE1' ' A' ' 102' ' ' PHE . . . -150.24 151.56 23.59 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 72.2 p -61.34 140.0 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.571 0.224 . . . . 0.0 110.895 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -39.85 -45.46 1.81 Allowed 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.04 -1.15 3.8 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.42 -10.66 9.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.63 0.252 . . . . 0.0 111.371 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.456 ' CE1' ' HA2' ' A' ' 97' ' ' GLY . 1.6 m-85 -105.45 159.09 16.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.208 0.527 . . . . 0.0 111.41 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.459 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 5.1 t80 -44.63 104.43 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.185 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.2 m -54.43 -35.29 62.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.875 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.459 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 0.3 OUTLIER -47.92 -60.36 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.728 0.299 . . . . 0.0 111.434 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 33.0 p -111.0 -46.39 3.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.717 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 106' ' ' THR . 6.4 mmtp 80.33 -15.67 0.73 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.841 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -74.56 -27.59 60.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.908 0.385 . . . . 0.0 110.394 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -123.54 140.0 53.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.516 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 25.1 p -60.16 -13.79 14.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.2 p -151.74 154.41 36.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.918 0.39 . . . . 0.0 111.859 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.437 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.56 -36.27 74.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.8 t -58.67 -40.08 82.51 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.733 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 118' ' ' TYR . 9.9 m -61.77 -23.76 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.303 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.3 p -79.33 -52.94 7.44 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.763 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.4 ptt-85 -70.05 -17.66 63.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.281 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.423 ' O ' ' ND2' ' A' ' 121' ' ' ASN . 4.6 m -82.79 -47.95 11.34 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.819 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.473 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.5 t80 -69.89 -21.59 63.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.934 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 p -88.18 -60.49 1.95 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' SER . . . . . 0.508 ' C ' ' H ' ' A' ' 122' ' ' SER . 42.6 m -57.83 -44.03 86.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.035 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.423 ' ND2' ' O ' ' A' ' 117' ' ' SER . 0.0 OUTLIER -70.31 22.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.508 ' H ' ' C ' ' A' ' 120' ' ' SER . 0.3 OUTLIER 46.66 90.27 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 179.465 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.461 ' HB2' ' CD1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.3 -44.33 92.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.511 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.964 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.414 -0.275 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.71 -37.36 3.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.85 0.357 . . . . 0.0 111.024 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 53.02 38.37 55.54 Favored Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.745 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.84 97.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.565 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.84 117.02 66.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.006 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.535 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 34.5 Cg_exo -60.76 124.12 14.36 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.556 2.171 . . . . 0.0 112.21 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.41 ' O ' ' CE2' ' A' ' 102' ' ' PHE . . . -110.32 100.97 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.11 140.19 17.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.914 0.388 . . . . 0.0 111.479 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.15 121.54 19.47 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -76.14 11.45 1.49 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.361 -0.836 . . . . 0.0 113.073 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.7 tpt -116.52 -55.23 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 95' ' ' ILE . 6.4 m -96.06 -47.7 5.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.429 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 114.35 6.33 20.15 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.429 ' CD1' ' HB2' ' A' ' 93' ' ' CYS . 2.0 mm -52.35 -177.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.411 ' H ' ' CG2' ' A' ' 95' ' ' ILE . 3.2 t -142.67 142.41 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-O 121.306 0.574 . . . . 0.0 111.571 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.99 -167.91 15.14 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.115 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.9 155.65 20.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -42.49 -36.43 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -99.18 -38.06 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.75 -15.32 52.79 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.49 ' CD1' ' HA2' ' A' ' 97' ' ' GLY . 0.3 OUTLIER -95.33 177.09 5.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.002 0.43 . . . . 0.0 111.486 -179.585 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 105' ' ' LYS . 10.3 t80 -61.53 120.64 10.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.138 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 87.0 p -70.85 -57.6 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -41.54 -29.96 0.19 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.8 m -126.3 -53.25 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 111.573 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 71.98 11.1 6.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.216 -179.597 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.31 -33.73 9.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.0 110.863 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -116.85 164.16 15.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.172 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 1.1 p -59.76 -38.13 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.999 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 p -150.34 154.09 37.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 0.0 111.575 -178.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.465 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 13.9 p -49.69 -34.22 8.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.274 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.433 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 5.9 t -65.66 -45.28 83.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.401 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t -57.34 -44.9 84.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.433 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.0 t -58.9 -63.15 1.4 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.649 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -51.47 -26.15 7.72 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.941 0.4 . . . . 0.0 110.187 179.322 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.8 t -68.51 -57.22 6.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -48.23 -39.6 21.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.938 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 8.1 t -68.19 -53.91 21.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.543 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 47.0 m -75.38 -3.05 31.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.091 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -112.62 -23.89 9.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.654 0.264 . . . . 0.0 111.291 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.0 t -167.57 171.11 10.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.959 0.409 . . . . 0.0 111.163 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.45 134.18 12.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.831 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.978 -179.947 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 50.28 -134.02 28.82 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.765 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.6 p -134.19 40.27 3.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.909 0.385 . . . . 0.0 110.739 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.5 116.87 49.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.865 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.04 138.89 75.82 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.455 2.104 . . . . 0.0 112.364 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.405 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -134.13 129.41 35.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.74 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 17.8 t -87.45 134.02 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.199 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 46.9 t -73.7 121.64 21.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.109 0.481 . . . . 0.0 110.772 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.512 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.6 mm-40 -63.25 -25.82 68.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.715 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.98 -58.38 2.49 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.14 -33.6 19.37 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.07 16.91 45.55 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.616 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.2 mm -91.57 134.44 30.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' ' 88' ' ' ALA . 2.9 t -99.23 137.6 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.348 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.437 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.57 -168.05 15.08 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.953 179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 74.8 p -104.32 140.71 37.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.644 0.259 . . . . 0.0 110.527 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.36 -37.47 3.37 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -78.82 7.71 6.64 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -179.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.87 -33.19 3.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.852 0.358 . . . . 0.0 111.344 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.463 ' CG ' ' HA ' ' A' ' 110' ' ' CYS . 2.4 m-30 -74.41 162.29 28.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.722 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.481 ' HB2' ' O ' ' A' ' 110' ' ' CYS . 8.0 t80 -55.88 89.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.433 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.1 m -41.33 -31.73 0.25 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.564 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 2.1 tppt? -46.04 -46.47 16.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 1.1 p -122.81 -37.11 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.066 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.556 ' HB2' ' O ' ' A' ' 106' ' ' THR . 10.9 mmtp 78.14 -36.94 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.684 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -62.04 -32.49 73.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.412 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.684 ' HB3' ' SG ' ' A' ' 114' ' ' CYS . 31.6 m-85 -114.39 129.84 56.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.411 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 103' ' ' PHE . 1.8 p -48.64 -63.03 1.2 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.994 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.3 p -106.8 165.85 11.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.313 0.578 . . . . 0.0 112.434 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.418 ' HB ' ' CE1' ' A' ' 103' ' ' PHE . 10.8 p -70.95 -26.29 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.021 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.1 p -66.77 -55.02 16.83 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.2 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.684 ' SG ' ' HB3' ' A' ' 109' ' ' PHE . 30.5 p -59.25 -21.17 59.18 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 5.3 p -77.65 -50.97 11.39 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.526 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -64.98 -19.66 66.09 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 1.1 m -74.6 -54.18 7.96 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.512 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.3 t80 -57.22 -26.46 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 178.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 55.2 p -85.35 -32.91 22.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.027 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.2 t -104.15 -8.43 19.44 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 117' ' ' SER . 3.9 m-80 -88.93 0.76 56.34 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m 61.13 79.64 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.5 tptt 52.28 86.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 27.7 tptt . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.904 179.831 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 112.525 -0.23 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.58 101.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 111.049 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -144.24 -82.47 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.89 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.1 m -86.41 76.75 9.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.988 0.423 . . . . 0.0 110.085 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -104.84 116.51 60.72 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.242 177.705 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -92.13 115.61 0.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.491 2.127 . . . . 0.0 112.594 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.401 ' O ' ' CG1' ' A' ' 96' ' ' VAL . . . -109.05 160.81 15.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.58 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.77 127.49 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.796 0.331 . . . . 0.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -80.07 113.62 18.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.482 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.85 -21.42 56.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.6 tpt -94.97 -58.46 2.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 22.6 m -80.44 -27.24 38.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.5 17.77 75.08 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.766 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.6 mm -89.14 132.42 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 CA-C-O 121.032 0.444 . . . . 0.0 110.476 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.401 ' CG1' ' O ' ' A' ' 88' ' ' ALA . 2.7 t -99.67 130.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.531 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.466 ' HA2' ' CE2' ' A' ' 102' ' ' PHE . . . -150.65 150.63 22.66 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.957 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.601 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 67.9 p -57.82 143.11 43.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 0.0 111.014 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.417 ' CD ' ' HG3' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -45.29 -47.58 13.03 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.667 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.62 -11.51 35.89 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.03 -20.69 13.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.957 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.466 ' CE2' ' HA2' ' A' ' 97' ' ' GLY . 2.1 m-85 -96.84 156.56 16.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.324 0.583 . . . . 0.0 112.026 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.476 ' CE1' ' HD3' ' A' ' 105' ' ' LYS . 2.7 t80 -43.72 96.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.991 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.452 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . 83.6 p -56.74 -26.17 56.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.155 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.476 ' HD3' ' CE1' ' A' ' 103' ' ' PHE . 0.1 OUTLIER -47.79 -51.57 22.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.727 0.298 . . . . 0.0 111.274 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.24 -24.14 3.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 104' ' ' SER . 14.6 mmtm 61.14 54.19 3.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.362 0.601 . . . . 0.0 109.728 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.0 mtp85 -124.68 -66.05 1.0 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.555 1.169 . . . . 0.0 108.63 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.44 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 15.1 m-85 -100.65 145.65 28.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 112.71 -2.041 . . . . 0.0 110.449 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -64.34 -10.03 21.7 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.7 p -151.65 154.18 35.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.574 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.9 p -61.55 -33.68 58.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.327 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -63.43 -41.77 98.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.106 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.44 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 63.9 m -62.51 -28.03 69.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -51.8 9.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.778 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 120' ' ' SER . 0.1 OUTLIER -68.16 -19.19 64.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.403 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 4.9 m -82.76 -47.09 12.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.95 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.443 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 2.0 t80 -66.26 -25.04 66.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.779 179.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.8 t -85.68 -54.56 4.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.476 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' SER . . . . . 0.422 ' HB2' ' O ' ' A' ' 116' ' ' ARG . 3.2 m -80.41 4.42 18.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.088 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 117' ' ' SER . 35.6 t30 -142.15 3.94 1.6 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.443 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.2 OUTLIER -154.12 173.09 16.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.15 0.5 . . . . 0.0 111.738 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -170.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.824 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.806 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.43 127.28 50.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.016 0.436 . . . . 0.0 111.204 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 160.37 19.93 0.03 OUTLIER Glycine 0 CA--C 1.524 0.62 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.862 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.423 ' HA ' ' HB ' ' A' ' 98' ' ' THR . 0.3 OUTLIER -130.76 -6.79 4.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 117.355 0.577 . . . . 0.0 111.383 179.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.53 116.97 4.03 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.53 -178.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.41 145.91 76.54 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.946 2.431 . . . . 0.0 112.782 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.79 126.5 51.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.321 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.8 126.28 41.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 111.314 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 116.49 17.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.259 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.29 -28.39 66.72 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.441 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.6 tpt -90.67 -58.23 2.55 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.431 ' HB2' HG12 ' A' ' 95' ' ' ILE . 10.3 m -83.94 -41.71 17.05 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.37 9.0 45.51 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.787 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.431 HG12 ' HB2' ' A' ' 93' ' ' CYS . 1.5 mm -56.17 179.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.4 ' H ' ' CG2' ' A' ' 95' ' ' ILE . 3.0 t -149.41 113.99 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.364 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.19 144.77 12.32 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.49 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 101' ' ' ALA . 4.6 p -62.75 138.71 58.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.409 ' C ' ' H ' ' A' ' 101' ' ' ALA . 1.9 ptm180 -31.43 -45.59 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -64.35 3.79 0.43 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 98' ' ' THR . . . -134.14 20.91 3.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.702 0.287 . . . . 0.0 110.914 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -132.06 155.28 48.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.022 0.439 . . . . 0.0 111.575 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.425 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.0 t80 -44.5 99.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.935 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.53 -27.18 15.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.927 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.425 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 6.8 tptp -47.8 -59.29 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 111.022 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.1 p -122.48 -33.96 3.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.94 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.18 -4.59 2.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.445 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 21.8 mtp180 -83.88 -24.97 30.6 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.854 0.359 . . . . 0.0 110.757 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -126.93 138.91 53.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.37 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.4 p -63.16 -12.95 31.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -156.25 159.14 38.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.81 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.31 -33.41 63.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 178.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 t -57.54 -41.76 81.6 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.327 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.87 -21.26 63.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.308 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.8 t -79.88 -51.67 8.84 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.135 0.493 . . . . 0.0 110.143 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -67.79 -17.47 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.4 t -82.38 -52.37 6.97 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.686 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.482 ' CZ ' ' HG2' ' A' ' 123' ' ' LYS . 5.6 t80 -60.32 -22.88 63.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.704 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.28 -43.4 11.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.205 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 38.7 m -82.85 -54.63 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' O ' ' A' ' 122' ' ' SER . 18.7 m-80 -64.65 -5.73 6.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.525 ' O ' ' O ' ' A' ' 121' ' ' ASN . 70.4 m 35.32 107.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.482 ' HG2' ' CZ ' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -77.55 -43.84 30.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.92 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' ' CB ' ' A' ' 83' ' ' SER . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.484 -0.246 . . . . 0.0 112.484 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 82' ' ' GLY . 1.7 p 163.05 -88.51 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.627 0.251 . . . . 0.0 110.791 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.82 48.39 2.27 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.51 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.8 p -114.89 9.97 16.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.565 0.221 . . . . 0.0 111.208 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.6 mt-10 -92.13 116.8 67.12 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.882 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 4.6 Cg_exo -74.46 148.15 37.49 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.703 2.269 . . . . 0.0 112.215 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.458 ' O ' ' CZ ' ' A' ' 102' ' ' PHE . . . -143.02 136.22 28.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.227 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 95' ' ' ILE . 17.0 t -90.9 133.8 31.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 20.3 t -64.9 124.82 23.01 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.457 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -69.52 3.83 2.16 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -118.41 -52.17 2.38 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.577 0.703 . . . . 0.0 109.862 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.452 ' HB2' HG12 ' A' ' 95' ' ' ILE . 5.9 m -96.9 -48.28 5.5 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.862 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.405 ' HA3' HG11 ' A' ' 89' ' ' VAL . . . 111.8 6.58 24.63 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -176.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.452 HG12 ' HB2' ' A' ' 93' ' ' CYS . 2.1 mm -52.18 -177.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.426 ' H ' ' CG2' ' A' ' 95' ' ' ILE . 2.5 t -138.53 136.11 43.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.265 0.555 . . . . 0.0 111.17 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.25 162.29 29.45 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.76 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.2 p -73.48 148.38 43.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.519 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -47.14 -31.05 3.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.467 -178.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 99' ' ' ARG . 26.6 mt-10 -85.95 -38.82 17.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.94 -23.76 63.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.674 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.49 ' HB3' ' HA ' ' A' ' 107' ' ' LYS . 6.9 m-85 -72.72 161.18 31.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.075 0.464 . . . . 0.0 111.822 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 105' ' ' LYS . 6.4 t80 -58.44 102.21 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.211 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.404 ' HA ' ' NZ ' ' A' ' 107' ' ' LYS . 77.3 p -38.99 -29.48 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.085 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 21.9 tttt -50.04 -60.7 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.0 p -128.21 -24.44 3.13 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 70.19 21.58 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.678 0.275 . . . . 0.0 111.06 -179.473 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -110.46 -9.44 14.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.56 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.436 ' CD1' ' CB ' ' A' ' 115' ' ' SER . 35.5 m-85 -128.93 151.39 49.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.745 0.307 . . . . 0.0 110.854 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 4.0 p -61.26 -27.16 68.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 p -160.48 157.6 27.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.968 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.429 ' HA ' ' CD2' ' A' ' 103' ' ' PHE . 10.9 p -53.18 -31.49 17.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.014 0.435 . . . . 0.0 110.332 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.403 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 25.0 p -68.03 -47.79 67.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.44 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.58 -43.4 84.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.927 0.394 . . . . 0.0 110.254 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.436 ' CB ' ' CD1' ' A' ' 109' ' ' PHE . 47.1 p -57.25 -61.12 2.69 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.594 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' A' ' 113' ' ' SER . 10.9 ptm180 -54.39 -25.74 26.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.108 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.31 -61.92 1.62 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.277 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.533 ' O ' ' HD1' ' A' ' 118' ' ' TYR . 0.9 OUTLIER -46.26 -43.94 15.99 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.094 0.473 . . . . 0.0 111.61 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.3 t -69.51 -53.73 17.68 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.693 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.7 m -69.07 0.16 5.0 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -91.33 -10.57 40.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.644 0.259 . . . . 0.0 111.103 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 73.88 84.28 0.11 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.855 0.359 . . . . 0.0 111.011 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -82.39 -80.73 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.817 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 tttt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.9 -179.896 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -111.65 -2.95 15.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.588 0.232 . . . . 0.0 111.402 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -122.69 131.92 8.49 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.558 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.4 m 40.78 94.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.791 0.329 . . . . 0.0 111.821 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -98.93 116.82 65.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.671 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.36 160.22 46.44 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.401 2.067 . . . . 0.0 112.423 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -136.47 141.45 43.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.216 179.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.46 126.38 67.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.848 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 50.5 t -86.57 85.52 7.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.369 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.447 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 6.7 mm-40 -46.21 -20.69 0.11 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -178.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.497 ' HB2' ' HB2' ' A' ' 118' ' ' TYR . 0.4 OUTLIER -82.95 -58.7 2.75 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.004 0.431 . . . . 0.0 111.325 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.0 m -88.99 -56.93 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.09 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 126.89 -10.37 7.06 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 3.9 mt -52.2 155.37 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 88' ' ' ALA . 46.4 t -147.58 125.16 3.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.856 0.36 . . . . 0.0 111.67 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -145.04 -167.8 12.45 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.92 128.46 36.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.48 0.64 . . . . 0.0 111.072 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.423 ' C ' ' H ' ' A' ' 101' ' ' ALA . 5.7 mtt180 -33.8 -66.12 0.17 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.311 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -47.31 -6.89 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.423 ' H ' ' C ' ' A' ' 99' ' ' ARG . . . -94.96 -50.32 5.16 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.81 179.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -51.46 172.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.428 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.0 t80 -55.01 110.16 0.63 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.921 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.6 p -68.45 -24.84 64.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.4 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.428 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 4.5 mttt -55.58 -55.44 31.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.255 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.7 -37.43 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.107 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.29 10.77 7.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.343 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.401 ' O ' ' CD1' ' A' ' 109' ' ' PHE . 37.3 mtm180 -113.48 -3.62 13.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.444 ' CE1' ' HD1' ' A' ' 118' ' ' TYR . 40.6 m-85 -147.33 161.77 40.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.226 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 7.1 p -85.5 24.33 1.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.8 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER 174.15 -175.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.574 0.702 . . . . 0.0 112.409 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.444 ' N ' ' OG ' ' A' ' 111' ' ' SER . 7.1 p -91.24 -54.51 7.34 Favored 'Isoleucine or valine' 0 C--O 1.25 1.104 0 CA-C-N 114.7 -1.136 . . . . 0.0 109.953 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.421 ' O ' ' CB ' ' A' ' 117' ' ' SER . 3.9 p -66.32 -27.41 67.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.493 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.2 t -63.47 -37.81 88.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.769 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.3 t -67.83 -67.19 0.48 Allowed 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -21.1 12.2 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.545 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 113' ' ' SER . 4.2 m -73.54 -58.33 3.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.497 ' HB2' ' HB2' ' A' ' 92' ' ' MET . 8.4 t80 -48.22 -35.22 11.48 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.4 t -84.45 -62.65 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.421 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.4 m -58.43 -54.98 40.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.56 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -86.53 -52.82 5.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.08 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.1 p 56.77 53.5 8.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.975 0.417 . . . . 0.0 110.617 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.75 -168.04 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.702 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.3 mttt . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.939 179.845 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.623 0.249 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 97.3 Cg_endo -84.81 132.33 4.73 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.624 2.216 . . . . 0.0 112.775 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -119.23 102.17 8.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.887 HG13 HG22 ' A' ' 96' ' ' VAL . 11.0 t -79.08 138.28 20.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.788 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -84.2 120.48 26.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.539 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -69.19 -20.54 63.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.838 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.5 -58.26 2.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.767 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.3 m -91.44 -29.68 16.91 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.39 -19.49 53.63 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.574 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.7 mt -54.44 134.36 17.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.815 0.34 . . . . 0.0 111.449 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.887 HG22 HG13 ' A' ' 89' ' ' VAL . 12.8 t -114.93 141.71 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.48 -173.4 20.62 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.978 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 p -89.78 142.65 27.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.75 -42.56 5.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -1.84 16.66 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.41 -28.02 7.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.317 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 0.8 OUTLIER -87.56 160.41 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 111.451 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.93 110.43 0.23 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.347 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.2 m -62.58 -27.31 69.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.397 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 1.1 ttmt -50.76 -60.28 3.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.801 0.334 . . . . 0.0 111.166 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.408 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.6 p -116.96 -40.37 3.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.71 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.423 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 82.93 -21.6 0.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.653 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -68.22 -32.38 72.55 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 25.9 m-85 -119.49 142.97 47.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -66.26 -11.22 48.94 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -152.85 155.27 36.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.887 0.375 . . . . 0.0 111.662 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.434 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -63.22 -34.06 64.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.065 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 82.5 p -58.94 -44.31 91.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.926 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 54.9 m -58.69 -24.6 61.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.534 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.82 -50.75 10.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.797 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -69.36 -19.28 63.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.407 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 1.4 m -82.1 -51.51 7.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.082 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.0 -26.0 68.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.85 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.37 -46.11 9.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.307 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.02 0.7 54.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.277 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 117' ' ' SER . 55.0 t30 . . . . . 0 C--N 1.33 -0.273 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.8 mm-40 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.548 0.213 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 15.8 Cg_exo -68.38 136.81 37.99 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.58 2.186 . . . . 0.0 112.43 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.97 116.31 22.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.876 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 96' ' ' VAL . 19.6 t -81.49 136.53 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.534 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -80.07 119.86 23.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.271 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.35 -22.6 66.83 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 2.9 tpt -91.21 -58.26 2.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.06 -29.83 19.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 98.41 -22.04 42.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.266 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.5 mm -54.79 136.34 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.961 0.41 . . . . 0.0 111.085 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 89' ' ' VAL . 6.5 t -108.03 139.9 28.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.889 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.465 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.7 158.52 27.72 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.299 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.2 p -68.99 143.68 54.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.83 0.315 . . . . 0.0 110.399 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -44.84 -41.92 7.47 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.91 -4.37 27.87 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.92 -27.32 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.303 . . . . 0.0 111.122 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -88.28 158.95 18.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.26 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.82 118.57 1.66 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.205 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 26.7 t -65.52 -27.0 68.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.542 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.455 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 16.4 tptp -52.32 -49.07 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 7.4 p -128.12 -42.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.335 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 22.9 mmtm 84.79 -20.88 0.27 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.455 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -75.33 -25.0 57.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.866 0.365 . . . . 0.0 110.616 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.418 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 45.6 m-85 -120.75 133.34 55.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.175 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.5 p -63.02 -12.75 28.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -151.62 153.78 35.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.004 0.43 . . . . 0.0 111.884 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.0 p -60.95 -35.49 65.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.045 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.5 t -59.62 -40.77 88.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.773 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 8.5 m -60.8 -27.66 68.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.224 179.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 t -74.73 -53.82 8.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.878 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -70.55 -17.58 62.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.59 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.1 m -81.83 -49.24 10.6 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.6 -25.25 65.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.778 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -83.93 -50.85 7.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.246 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.0 t -61.15 -51.43 69.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.18 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.671 179.668 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.74 0.305 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.33 131.3 3.53 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.887 2.392 . . . . 0.0 112.759 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -116.78 106.65 13.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.906 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.718 HG13 HG22 ' A' ' 96' ' ' VAL . 4.7 t -82.06 126.31 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.416 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.33 122.45 22.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.414 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -66.3 -22.15 66.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.78 -58.23 2.55 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 m -86.13 -33.39 20.9 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.18 16.91 54.95 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.425 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.72 132.87 34.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.423 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.718 HG22 HG13 ' A' ' 89' ' ' VAL . 3.5 t -108.77 135.93 46.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.382 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.36 171.49 30.24 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.288 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 39.0 p -72.45 137.6 46.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.573 0.225 . . . . 0.0 110.581 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.403 ' HG2' ' HG2' ' A' ' 107' ' ' LYS . 20.0 mtp180 -43.27 -40.94 3.72 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.27 0.23 6.79 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -118.97 -19.15 8.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.646 0.26 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.457 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.5 m-85 -93.38 158.84 15.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.154 0.502 . . . . 0.0 111.745 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 105' ' ' LYS . 2.7 t80 -44.63 111.68 0.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.32 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 69.6 m -64.26 -31.16 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.426 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.453 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -49.63 -57.29 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.221 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.572 HG22 ' NE ' ' A' ' 108' ' ' ARG . 0.2 OUTLIER -113.79 -46.1 3.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 85.33 -26.09 0.11 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.424 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.572 ' NE ' HG22 ' A' ' 106' ' ' THR . 14.1 mtm180 -69.86 -32.99 71.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.875 0.369 . . . . 0.0 110.597 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.4 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 22.8 m-85 -118.25 138.48 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.437 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 29.5 p -63.12 -13.73 40.04 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.7 p -150.55 152.96 34.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.975 0.417 . . . . 0.0 111.739 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.408 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.79 -33.75 61.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.991 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 8.0 t -60.7 -37.97 83.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.803 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 58.1 m -62.87 -24.7 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.162 179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -50.24 10.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -70.53 -19.52 62.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.398 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 11.3 t -80.98 -51.17 8.82 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.802 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -63.69 -26.01 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.65 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.47 -43.36 11.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.438 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -87.56 -0.34 56.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.395 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.9 m120 . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.87 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.752 0.311 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.2 Cg_endo -86.53 131.15 3.38 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.885 2.39 . . . . 0.0 112.88 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.817 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -108.89 164.63 12.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.787 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 20.7 t -138.13 126.28 30.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.498 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -73.85 108.88 6.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.076 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.42 ' HG2' ' CZ ' ' A' ' 118' ' ' TYR . 1.9 tp10 -55.26 -19.18 7.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.304 -178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.2 tpt -100.29 -58.68 1.85 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -178.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.83 -30.89 40.52 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 94.09 -21.0 44.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.454 -0.879 . . . . 0.0 112.431 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 33.5 mm -52.49 133.71 14.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.528 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.817 HG13 ' O ' ' A' ' 88' ' ' ALA . 16.4 t -110.43 140.86 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.252 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.33 -167.79 14.74 Favored Glycine 0 C--O 1.227 -0.298 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.802 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 70.4 p -98.38 142.16 30.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.969 0.384 . . . . 0.0 110.339 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HG2' ' NZ ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.65 -42.53 7.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.08 -1.13 16.12 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.06 -31.29 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.862 0.363 . . . . 0.0 111.091 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -81.26 161.12 24.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.334 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.466 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 1.2 t80 -44.69 118.08 1.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.139 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.8 m -71.95 -29.27 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.588 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.466 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 19.5 tptp -57.84 -38.71 76.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.43 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 44.1 p -128.21 -48.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 11.6 mmtp 84.09 -31.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 55.9 mtm180 -62.09 -46.99 86.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.837 0.351 . . . . 0.0 110.28 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -105.17 143.28 33.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.474 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 30.7 p -66.72 -11.01 52.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -154.06 156.44 37.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.938 0.399 . . . . 0.0 111.689 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.8 p -64.93 -33.73 65.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.91 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 0.2 OUTLIER -58.03 -45.47 86.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.838 179.142 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 95.4 m -59.33 -24.48 63.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.334 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.6 t -76.1 -50.17 15.39 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.726 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -70.39 -21.54 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.491 179.257 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -49.27 12.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.886 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 91' ' ' GLU . 1.7 t80 -65.87 -25.88 67.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.873 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.0 p -88.01 -40.06 14.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.132 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 1.1 t -90.43 -4.09 57.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.845 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 47.4 t30 . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.684 0.278 . . . . 0.0 111.3 -179.763 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.254 0 CA-C-O 120.524 0.202 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_exo -65.06 126.45 16.49 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.551 2.167 . . . . 0.0 112.697 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -118.0 102.51 9.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.783 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.845 HG13 HG22 ' A' ' 96' ' ' VAL . 7.3 t -79.24 132.74 31.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.432 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 32.2 t -80.41 121.7 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.582 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -69.39 -20.2 63.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.775 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 7.8 tpt -89.52 -58.2 2.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 6.6 m -89.15 -31.7 17.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.09 17.96 51.82 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.523 -0.846 . . . . 0.0 112.473 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mm -91.77 134.05 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.384 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.845 HG22 HG13 ' A' ' 89' ' ' VAL . 3.2 t -109.92 137.51 41.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.182 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.54 -178.05 25.04 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.983 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.7 p -81.87 136.74 35.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.789 0.294 . . . . 0.0 110.249 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mtp180 -43.2 -38.42 2.5 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.64 3.83 3.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.17 -21.05 6.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.688 0.28 . . . . 0.0 111.435 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.8 m-85 -91.07 160.71 15.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.09 0.471 . . . . 0.0 111.504 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.493 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.57 108.23 0.11 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.096 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 t -57.54 -42.54 83.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.842 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.493 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 2.8 mmpp? -46.5 -60.29 2.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.45 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -102.52 -52.41 3.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.048 -179.827 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.454 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 86.57 -27.31 0.08 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.507 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.94 -32.57 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.9 0.381 . . . . 0.0 110.72 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -117.4 144.41 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.644 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.3 p -66.08 -11.36 48.15 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.9 p -154.87 157.38 37.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.902 0.382 . . . . 0.0 111.644 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.4 p -65.29 -34.77 72.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.978 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.408 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 62.3 p -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.736 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.71 -22.04 63.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.389 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.88 -48.39 11.59 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 2.4 ptp180 -70.72 -20.59 62.64 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 5.0 t -78.95 -50.7 10.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.95 -24.17 67.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.529 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.5 p -88.19 -34.39 17.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.805 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 66.4 m -93.81 -6.17 46.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.013 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 58.6 m-80 . . . . . 0 C--N 1.332 -0.182 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 CA--C 1.528 0.12 0 CA-C-O 120.76 0.314 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 89.1 Cg_endo -85.73 131.58 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.791 2.327 . . . . 0.0 112.792 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.725 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.81 99.52 7.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.306 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 96' ' ' VAL . 38.5 t -79.08 126.27 38.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.434 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.16 115.22 10.05 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 109' ' ' PHE . 2.4 tt0 -71.59 -21.24 61.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.704 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -13.26 23.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.441 ' HB2' HD12 ' A' ' 95' ' ' ILE . 55.8 m -132.05 -43.69 0.96 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 118.131 0.423 . . . . 0.0 111.666 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 119.35 -32.48 5.05 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.441 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.5 mp -52.54 132.33 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.84 0.352 . . . . 0.0 111.855 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.689 HG22 HG13 ' A' ' 89' ' ' VAL . 10.9 t -115.55 141.77 31.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.704 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -176.73 23.71 Favored Glycine 0 C--O 1.228 -0.273 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.116 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.9 p -86.99 142.19 28.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.791 0.296 . . . . 0.0 110.292 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.53 -41.56 2.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.167 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.95 -1.58 10.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.04 -17.62 8.95 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 2.2 m-85 -97.2 159.05 15.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.022 0.439 . . . . 0.0 111.669 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.482 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 4.7 t80 -44.93 113.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.9 t -59.91 -39.53 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.776 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -46.68 -60.31 2.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.81 0.338 . . . . 0.0 111.568 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.435 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 22.5 p -106.61 -52.16 2.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.725 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 84.77 -23.07 0.18 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.461 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.0 -27.93 60.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.686 0.279 . . . . 0.0 110.922 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 32.1 m-85 -119.52 137.41 53.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.465 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.414 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 26.9 p -57.68 -15.01 6.49 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.0 p -152.24 154.56 36.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.997 0.427 . . . . 0.0 112.001 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.454 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -63.26 -35.82 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.023 178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.6 p -57.85 -38.97 76.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.614 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.9 m -60.93 -24.41 66.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.347 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 -51.14 10.01 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 ptp85 -70.36 -17.58 63.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.321 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.3 m -83.94 -50.06 8.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.14 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.85 -24.04 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.864 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.1 t -88.11 -49.34 7.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.931 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 2.0 t -77.9 -58.31 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.995 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 C--N 1.33 -0.245 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.789 0.328 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.27 135.21 22.22 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.019 2.479 . . . . 0.0 112.613 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.57 123.02 39.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.638 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.533 HG13 HG22 ' A' ' 96' ' ' VAL . 13.7 t -80.31 144.19 11.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.67 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 48.7 t -90.06 119.79 30.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.476 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -64.23 -23.52 67.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.841 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -91.61 -58.17 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.0 -29.33 19.57 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.77 -23.18 37.11 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.978 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.6 mm -53.9 137.12 14.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.933 0.397 . . . . 0.0 111.059 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.533 HG22 HG13 ' A' ' 89' ' ' VAL . 6.2 t -108.53 138.44 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.704 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.72 150.86 22.92 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.086 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.0 p -57.61 138.62 55.11 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -46.52 -36.52 6.82 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -70.26 0.67 5.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.55 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.58 -19.41 7.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.318 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -92.08 158.07 16.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 105' ' ' LYS . 2.2 t80 -45.2 115.35 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.113 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 33.4 p -62.8 -28.9 70.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.555 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HB3' ' CD2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -54.12 -60.5 3.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 0.0 111.187 -179.602 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.442 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.6 OUTLIER -107.34 -46.25 3.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.078 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.97 -26.68 0.1 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.515 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 7.5 mtm-85 -71.97 -23.05 61.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 91' ' ' GLU . 24.7 m-85 -121.58 140.72 51.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.6 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.2 p -66.94 -12.14 58.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.46 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.5 p -152.91 154.85 35.88 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.441 . . . . 0.0 112.059 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.448 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -62.91 -35.57 71.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.911 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.2 p -58.21 -40.63 82.13 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.792 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.56 -24.53 65.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.406 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -79.91 -49.36 12.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -20.66 62.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.408 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 5.6 m -80.25 -52.02 8.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.782 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.4 t80 -63.7 -25.89 68.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.715 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -88.69 -42.86 11.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.429 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.6 t -88.71 -2.02 58.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.247 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.838 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 CA--C 1.53 0.186 0 CA-C-O 120.488 0.185 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -61.52 133.03 43.53 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.51 2.14 . . . . 0.0 112.442 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -121.84 114.24 20.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.545 HG13 HG22 ' A' ' 96' ' ' VAL . 19.7 t -78.99 135.27 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.432 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 38.6 t -80.97 120.18 24.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.744 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.456 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -67.43 -21.39 65.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.971 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -58.32 2.53 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.3 m -90.85 -27.72 18.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.46 -19.91 52.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.485 -0.865 . . . . 0.0 112.146 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.3 mm -57.76 142.16 13.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.987 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.545 HG22 HG13 ' A' ' 89' ' ' VAL . 4.3 t -115.67 142.91 26.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.952 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.34 161.03 28.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.112 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 71.1 p -69.26 140.11 54.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.447 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 12.5 ptm180 -41.58 -41.25 2.11 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -71.31 0.66 7.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.94 -21.15 6.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.577 0.227 . . . . 0.0 111.594 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -92.64 161.25 14.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.933 0.397 . . . . 0.0 111.33 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.463 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 3.3 t80 -44.65 100.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.082 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.9 m -55.98 -25.01 42.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.731 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.463 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 1.1 tptp -54.4 -59.83 4.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 111.044 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.437 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.0 OUTLIER -117.19 -40.64 3.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.84 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 84.32 -17.52 0.46 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.663 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -61.68 -46.09 91.23 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.781 0.324 . . . . 0.0 110.588 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 9.0 m-85 -108.44 160.26 16.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.55 -5.78 49.09 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -161.6 164.33 29.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.098 0.475 . . . . 0.0 112.062 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 113' ' ' SER . 9.2 p -66.6 -44.58 89.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.299 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 112' ' ' VAL . 55.1 p -57.94 -36.11 72.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.853 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -67.23 -18.96 65.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.498 178.981 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 7.0 p -85.88 -46.73 10.32 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.623 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -74.78 -20.74 59.68 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.527 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 39.6 m -81.32 -53.63 6.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.52 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.456 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 15.7 t80 -67.15 -20.06 65.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.149 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -88.23 -49.86 6.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.203 0.525 . . . . 0.0 110.894 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 t -80.22 6.3 12.21 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.761 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.527 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.2 m-80 . . . . . 0 C--N 1.332 -0.182 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.825 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.707 0.289 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.9 Cg_endo -82.25 128.62 5.66 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.76 2.307 . . . . 0.0 113.277 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.822 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -106.5 169.85 8.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.814 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -139.29 126.32 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.84 0.352 . . . . 0.0 111.908 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 35.5 t -78.51 114.63 17.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.399 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -63.68 -18.63 64.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.244 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.5 tpt -94.38 -58.37 2.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.7 m -88.18 -25.37 22.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.13 22.13 61.54 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.385 -0.912 . . . . 0.0 112.24 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.9 mm -89.69 128.45 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.79 0.328 . . . . 0.0 110.479 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.822 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.1 t -103.65 134.56 44.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.15 -169.1 15.89 Favored Glycine 0 C--O 1.228 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.122 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.7 p -95.3 137.25 34.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.436 ' HG2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -43.58 -40.46 4.04 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.8 3.39 8.15 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.02 -28.61 4.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 111.436 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 0.4 OUTLIER -79.09 161.53 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 111.82 -179.407 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 2.3 t80 -44.67 106.4 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.237 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 47.5 m -62.94 -25.43 68.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.536 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -51.49 -60.39 3.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.778 0.323 . . . . 0.0 111.139 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.441 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.2 p -113.5 -36.76 4.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.441 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.57 -34.25 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.494 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.59 -51.06 68.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.819 0.342 . . . . 0.0 110.685 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -101.93 140.71 35.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.652 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 31.3 p -64.18 -14.45 55.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 112.31 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.1 p -151.67 154.22 35.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.842 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.429 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -63.16 -32.77 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.746 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' ARG . 4.2 t -57.74 -44.69 86.21 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.741 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 65.2 m -59.65 -27.67 66.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.171 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 t -72.12 -55.29 7.56 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.978 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -69.28 -18.1 63.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.907 0.384 . . . . 0.0 110.122 178.816 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 1.8 m -79.55 -54.02 6.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -61.17 -24.77 66.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.079 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.8 t -83.23 -52.93 6.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.512 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -50.9 8.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 37.8 t30 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 3.5 mm-40 . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.466 0.174 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 6.2 Cg_exo -77.86 131.54 11.22 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.359 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -120.35 98.93 6.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.69 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.801 HG13 HG22 ' A' ' 96' ' ' VAL . 11.6 t -79.74 133.76 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.249 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -78.08 118.66 20.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.646 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.5 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 7.1 mm-40 -65.79 -20.51 66.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.852 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -58.23 2.47 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.479 ' HB2' HD13 ' A' ' 95' ' ' ILE . 5.7 m -88.58 -31.89 18.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.05 19.28 43.42 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.865 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.479 HD13 ' HB2' ' A' ' 93' ' ' CYS . 3.2 mp -89.96 128.39 41.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.116 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.801 HG22 HG13 ' A' ' 89' ' ' VAL . 4.8 t -103.71 137.3 32.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.253 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.51 -174.96 22.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.766 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 p -90.49 143.17 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.952 0.376 . . . . 0.0 110.333 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 6.7 ptm180 -43.96 -42.23 5.8 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.143 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -71.67 0.01 9.79 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.91 -28.27 7.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 111.321 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.405 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 1.5 m-85 -87.96 160.08 18.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.2 t80 -44.98 105.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.4 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.4 p -57.43 -26.4 61.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.435 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -53.62 -60.04 3.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.163 -179.795 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.431 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.3 p -115.1 -43.55 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 83.57 -21.32 0.28 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.498 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -67.69 -34.07 76.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.74 0.305 . . . . 0.0 110.834 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.486 ' CE2' ' CD2' ' A' ' 118' ' ' TYR . 19.2 m-85 -118.42 148.22 42.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.502 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.405 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 14.9 p -66.83 -7.6 22.72 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.4 p -163.31 166.16 23.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.928 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 113' ' ' SER . 10.6 p -66.66 -46.19 86.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.453 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.496 ' N ' HG13 ' A' ' 112' ' ' VAL . 11.5 p -56.99 -39.69 75.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.14 0.495 . . . . 0.0 109.815 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 1.6 t -63.71 -18.91 64.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.478 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.1 t -85.56 -47.17 10.13 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -73.24 -19.73 61.01 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 8.4 t -82.19 -53.38 6.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.476 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.5 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 14.4 t80 -65.19 -20.45 66.45 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.141 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.4 t -87.99 -50.37 6.46 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.488 . . . . 0.0 110.632 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.3 m -81.48 3.61 24.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.071 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.4 m-20 . . . . . 0 N--CA 1.462 0.137 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.93 136.9 3.74 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.979 2.452 . . . . 0.0 112.427 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.73 108.25 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.731 HG13 HG22 ' A' ' 96' ' ' VAL . 9.8 t -81.62 128.08 39.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -75.43 120.43 20.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.535 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.454 ' HG2' ' CE1' ' A' ' 118' ' ' TYR . 1.5 tt0 -68.28 -17.77 64.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.719 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 9.6 tpt -92.62 -58.14 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.9 m -88.18 -31.99 18.83 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 -178.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.73 19.01 49.87 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.254 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -93.82 132.98 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 120.951 0.405 . . . . 0.0 110.063 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.731 HG22 HG13 ' A' ' 89' ' ' VAL . 2.9 t -105.04 133.47 49.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.387 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.57 151.59 23.59 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.833 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.6 p -59.14 140.31 56.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.019 0.41 . . . . 0.0 110.604 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.402 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 32.2 ptt85 -44.56 -33.9 1.93 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.24 -0.436 . . . . 0.0 112.007 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -68.13 -2.9 8.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.07 -1.13 7.77 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -109.55 158.06 18.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.178 0.513 . . . . 0.0 111.73 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.472 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 3.9 t80 -44.43 100.59 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.178 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.4 OUTLIER -49.87 -28.39 6.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.884 -179.336 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -50.44 -54.64 20.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.848 0.356 . . . . 0.0 111.216 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 2.1 p -128.01 -38.01 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.147 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 8.3 mmtp 81.27 -9.52 1.29 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.535 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -68.85 -34.29 75.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.601 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -118.35 143.74 46.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.1 p -63.7 -13.09 40.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -155.8 158.27 37.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.988 0.423 . . . . 0.0 111.907 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.4 p -65.73 -36.06 76.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.837 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 60.7 p -58.15 -39.2 78.2 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.568 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.67 -21.58 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.367 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.6 p -82.34 -48.41 11.19 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.673 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.401 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 27.5 ptt180 -71.95 -19.68 61.86 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.422 ' O ' ' N ' ' A' ' 121' ' ' ASN . 4.0 m -79.06 -51.88 8.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.454 ' CE1' ' HG2' ' A' ' 91' ' ' GLU . 1.9 t80 -63.56 -23.58 67.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.554 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 16.6 p -88.37 -35.74 16.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.739 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -92.59 -6.16 50.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.981 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 117' ' ' SER . 71.3 m-80 . . . . . 0 C--N 1.33 -0.252 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.812 0.339 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.408 ' HB2' ' CG1' ' A' ' 96' ' ' VAL . 92.2 Cg_endo -85.24 149.47 10.48 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.865 2.377 . . . . 0.0 112.546 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.455 ' C ' HG13 ' A' ' 96' ' ' VAL . . . -124.71 120.9 33.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.955 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.513 HG22 ' CG2' ' A' ' 96' ' ' VAL . 22.0 t -79.11 137.74 21.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.624 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 39.0 t -81.16 114.9 20.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.96 -22.1 62.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -95.9 -58.31 2.13 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.595 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.4 m -89.29 -28.98 19.51 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.12 -24.32 32.32 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.474 -179.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 93' ' ' CYS . 4.5 mp -52.71 138.1 11.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.914 0.388 . . . . 0.0 111.01 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.513 ' CG2' HG22 ' A' ' 89' ' ' VAL . 8.7 t -113.33 141.3 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.666 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.404 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.73 156.12 26.52 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.116 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.6 p -65.8 142.71 57.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.516 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -44.41 -34.96 2.2 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.442 ' N ' ' HG2' ' A' ' 99' ' ' ARG . 2.7 tp10 -74.17 -0.68 17.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.24 -18.9 7.25 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.404 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.5 m-85 -91.97 161.38 14.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.49 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.7 97.28 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.203 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.421 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 9.0 t -47.74 -28.88 2.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.064 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 0.8 OUTLIER -54.43 -60.42 3.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 p -119.64 -39.25 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 81.64 -14.15 0.82 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.719 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -64.19 -39.34 93.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.758 0.313 . . . . 0.0 110.549 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 115' ' ' SER . 11.5 m-85 -112.07 153.51 26.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.386 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.5 p -68.39 -7.69 33.72 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -165.53 168.41 16.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.051 0.453 . . . . 0.0 111.94 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.466 HG13 ' N ' ' A' ' 113' ' ' SER . 10.2 p -68.12 -43.27 85.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.237 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.466 ' N ' HG13 ' A' ' 112' ' ' VAL . 16.6 t -57.66 -40.61 79.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.8 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.34 -19.06 65.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.563 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.435 ' HA ' ' CD1' ' A' ' 109' ' ' PHE . 4.9 p -84.29 -45.35 12.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.53 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -74.21 -19.84 60.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.848 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.8 t -80.81 -53.88 6.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.584 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.404 ' HD1' ' CZ ' ' A' ' 109' ' ' PHE . 10.1 t80 -66.72 -22.39 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.999 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 t -88.31 -48.78 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.917 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.6 m -81.12 2.88 25.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.146 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.2 m120 . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.956 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.878 0.371 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 85.1 Cg_endo -84.94 128.42 3.75 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.857 2.371 . . . . 0.0 112.79 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.787 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -110.02 167.3 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.571 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.1 t -137.95 126.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.591 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.73 110.53 8.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.495 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 6.5 mp0 -58.38 -21.13 49.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.2 tpt -96.9 -58.52 2.01 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -82.96 -27.85 30.2 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.6 20.89 60.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.095 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -88.72 129.07 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.0 t -104.93 136.35 38.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 111.328 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -169.68 16.73 Favored Glycine 0 C--O 1.227 -0.289 0 N-CA-C 111.736 -0.546 . . . . 0.0 111.736 179.272 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.6 p -91.43 136.65 32.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.083 0.441 . . . . 0.0 110.137 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.46 ' HA ' ' CE ' ' A' ' 107' ' ' LYS . 20.7 mtp85 -42.9 -38.43 2.19 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.66 9.19 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.76 -34.66 4.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.999 0.428 . . . . 0.0 110.856 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -74.09 161.4 30.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 112.075 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 107' ' ' LYS . 4.6 t80 -44.34 152.16 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.886 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.1 m -96.16 -46.2 6.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.315 . . . . 0.0 111.559 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -47.8 -49.52 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -179.299 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.404 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 74.1 p -105.29 -49.0 3.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.33 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 103' ' ' PHE . 0.1 OUTLIER 82.95 -46.73 0.14 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.157 -179.632 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -60.88 -45.28 95.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.984 0.421 . . . . 0.0 110.487 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -96.88 145.38 25.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -68.73 -9.65 51.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -155.96 158.41 37.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.956 0.408 . . . . 0.0 111.757 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.452 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.0 p -63.96 -36.48 76.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.896 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.4 t -57.27 -44.05 83.63 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.731 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.7 m -60.0 -26.13 65.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.017 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 p -73.46 -52.21 14.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -69.55 -20.81 63.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.245 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.85 -53.1 7.44 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.996 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.495 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.8 t80 -63.74 -25.15 68.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.987 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.5 t -81.26 -55.48 4.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.6 m -79.44 -52.42 8.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.47 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 t30 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.737 -179.216 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.428 0.156 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.27 129.69 29.35 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.46 2.107 . . . . 0.0 112.661 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.93 109.7 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.615 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.711 HG13 HG22 ' A' ' 96' ' ' VAL . 11.3 t -82.29 131.71 33.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.834 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 45.1 t -79.43 119.81 22.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.44 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.477 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.2 mt-10 -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.1 tpt -88.52 -58.26 2.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 11.7 m -86.96 -35.6 18.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.679 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.99 -26.45 23.09 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.102 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -52.61 132.6 14.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 111.229 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.711 HG22 HG13 ' A' ' 89' ' ' VAL . 11.7 t -106.67 139.05 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.242 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.452 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.24 151.56 23.59 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 72.2 p -61.34 140.0 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.571 0.224 . . . . 0.0 110.895 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -39.85 -45.46 1.81 Allowed 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.04 -1.15 3.8 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.42 -10.66 9.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.63 0.252 . . . . 0.0 111.371 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.452 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.6 m-85 -105.45 159.09 16.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.208 0.527 . . . . 0.0 111.41 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.459 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 5.1 t80 -44.63 104.43 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.185 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.2 m -54.43 -35.29 62.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.875 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.459 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 0.3 OUTLIER -47.92 -60.36 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.728 0.299 . . . . 0.0 111.434 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.518 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 33.0 p -111.0 -46.39 3.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.717 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 106' ' ' THR . 6.4 mmtp 80.33 -15.67 0.73 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.841 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -74.56 -27.59 60.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.908 0.385 . . . . 0.0 110.394 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -123.54 140.0 53.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.516 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 25.1 p -60.16 -13.79 14.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.2 p -151.74 154.41 36.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.918 0.39 . . . . 0.0 111.859 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.56 -36.27 74.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 8.8 t -58.67 -40.08 82.51 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.733 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 118' ' ' TYR . 9.9 m -61.77 -23.76 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.303 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.3 p -79.33 -52.94 7.44 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.763 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 113' ' ' SER . 16.4 ptt-85 -70.05 -17.66 63.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.281 178.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.6 m -82.79 -47.95 11.34 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.819 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.5 t80 -69.89 -21.59 63.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.934 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 p -88.18 -60.49 1.95 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.6 m -57.83 -44.03 86.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.035 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--N 1.328 -0.327 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.945 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.608 0.242 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.579 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 34.5 Cg_exo -60.76 124.12 14.36 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.556 2.171 . . . . 0.0 112.21 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.41 ' O ' ' CE2' ' A' ' 102' ' ' PHE . . . -110.32 100.97 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 95' ' ' ILE . 16.7 t -79.11 140.19 17.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.914 0.388 . . . . 0.0 111.479 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.15 121.54 19.47 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -76.14 11.45 1.49 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.361 -0.836 . . . . 0.0 113.073 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.7 tpt -116.52 -55.23 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.454 ' HB2' ' CD1' ' A' ' 95' ' ' ILE . 6.4 m -96.06 -47.7 5.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.429 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 114.35 6.33 20.15 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.762 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.0 mm -52.35 -177.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.762 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.2 t -142.67 142.41 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-O 121.306 0.574 . . . . 0.0 111.571 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.99 -167.91 15.14 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.115 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.47 ' OG1' ' HB3' ' A' ' 101' ' ' ALA . 0.2 OUTLIER -108.9 155.65 20.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 178.511 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -42.49 -36.43 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -99.18 -38.06 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.47 ' HB3' ' OG1' ' A' ' 98' ' ' THR . . . -62.75 -15.32 52.79 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.497 ' CD1' ' HA3' ' A' ' 97' ' ' GLY . 0.3 OUTLIER -95.33 177.09 5.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.002 0.43 . . . . 0.0 111.486 -179.585 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 105' ' ' LYS . 10.3 t80 -61.53 120.64 10.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.138 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 87.0 p -70.85 -57.6 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -41.54 -29.96 0.19 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.59 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' ' 108' ' ' ARG . 2.8 m -126.3 -53.25 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 111.573 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 71.98 11.1 6.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.216 -179.597 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.613 ' HB2' HG22 ' A' ' 106' ' ' THR . 0.1 OUTLIER -103.31 -33.73 9.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.0 110.863 179.915 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -116.85 164.16 15.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.172 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 1.1 p -59.76 -38.13 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.999 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 p -150.34 154.09 37.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 0.0 111.575 -178.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.471 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 13.9 p -49.69 -34.22 8.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.274 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 5.9 t -65.66 -45.28 83.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.401 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t -57.34 -44.9 84.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.433 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.0 t -58.9 -63.15 1.4 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.649 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -51.47 -26.15 7.72 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.941 0.4 . . . . 0.0 110.187 179.322 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.8 t -68.51 -57.22 6.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -48.23 -39.6 21.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.938 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 8.1 t -68.19 -53.91 21.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.543 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 47.0 m -75.38 -3.05 31.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.091 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.3 t30 . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.654 0.264 . . . . 0.0 111.291 -179.839 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.533 0.206 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 27.7 Cg_exo -62.04 138.89 75.82 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.455 2.104 . . . . 0.0 112.364 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -134.13 129.41 35.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.74 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 96' ' ' VAL . 17.8 t -87.45 134.02 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.199 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 46.9 t -73.7 121.64 21.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.109 0.481 . . . . 0.0 110.772 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.521 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.6 mm-40 -63.25 -25.82 68.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.715 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.98 -58.38 2.49 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.14 -33.6 19.37 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.07 16.91 45.55 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.616 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.2 mm -91.57 134.44 30.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 89' ' ' VAL . 2.9 t -99.23 137.6 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.348 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.435 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.57 -168.05 15.08 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.953 179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 74.8 p -104.32 140.71 37.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.644 0.259 . . . . 0.0 110.527 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.36 -37.47 3.37 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -78.82 7.71 6.64 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -179.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.87 -33.19 3.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.852 0.358 . . . . 0.0 111.344 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.474 ' CG ' ' HA ' ' A' ' 110' ' ' CYS . 2.4 m-30 -74.41 162.29 28.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.722 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 110' ' ' CYS . 8.0 t80 -55.88 89.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.433 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.1 m -41.33 -31.73 0.25 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.564 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.496 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 2.1 tppt? -46.04 -46.47 16.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 1.1 p -122.81 -37.11 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.066 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 10.9 mmtp 78.14 -36.94 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.684 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -62.04 -32.49 73.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.412 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.693 ' HB3' ' SG ' ' A' ' 114' ' ' CYS . 31.6 m-85 -114.39 129.84 56.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.411 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 103' ' ' PHE . 1.8 p -48.64 -63.03 1.2 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.994 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.3 p -106.8 165.85 11.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.313 0.578 . . . . 0.0 112.434 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 103' ' ' PHE . 10.8 p -70.95 -26.29 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.021 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.409 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 71.1 p -66.77 -55.02 16.83 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.2 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.693 ' SG ' ' HB3' ' A' ' 109' ' ' PHE . 30.5 p -59.25 -21.17 59.18 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.431 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 5.3 p -77.65 -50.97 11.39 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.526 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 7.9 ptp85 -64.98 -19.66 66.09 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.297 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 1.1 m -74.6 -54.18 7.96 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.521 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.3 t80 -57.22 -26.46 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 178.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 55.2 p -85.35 -32.91 22.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.027 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.2 t -104.15 -8.43 19.44 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 117' ' ' SER . 3.9 m-80 . . . . . 0 C--N 1.33 -0.259 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.113 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -92.13 115.61 0.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.491 2.127 . . . . 0.0 112.594 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.602 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -109.05 160.81 15.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.58 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.454 HG22 HG13 ' A' ' 96' ' ' VAL . 21.6 t -139.77 127.49 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.796 0.331 . . . . 0.0 111.408 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -80.07 113.62 18.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.482 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.85 -21.42 56.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.6 tpt -94.97 -58.46 2.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 22.6 m -80.44 -27.24 38.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.5 17.77 75.08 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.766 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.6 mm -89.14 132.42 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 CA-C-O 121.032 0.444 . . . . 0.0 110.476 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.602 HG13 ' O ' ' A' ' 88' ' ' ALA . 2.7 t -99.67 130.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.531 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLY . . . . . 0.464 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.65 150.63 22.66 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.957 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 67.9 p -57.82 143.11 43.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 0.0 111.014 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.409 ' CG ' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -45.29 -47.58 13.03 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.667 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.62 -11.51 35.89 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.03 -20.69 13.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.957 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.464 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 2.1 m-85 -96.84 156.56 16.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.324 0.583 . . . . 0.0 112.026 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.483 ' CE1' ' HD3' ' A' ' 105' ' ' LYS . 2.7 t80 -43.72 96.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.991 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . 83.6 p -56.74 -26.17 56.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.155 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HD3' ' CE1' ' A' ' 103' ' ' PHE . 0.1 OUTLIER -47.79 -51.57 22.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.727 0.298 . . . . 0.0 111.274 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.24 -24.14 3.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 104' ' ' SER . 14.6 mmtm 61.14 54.19 3.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.362 0.601 . . . . 0.0 109.728 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 108' ' ' ARG . 45.0 mtp85 -124.68 -66.05 1.0 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.555 1.169 . . . . 0.0 108.63 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.458 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 15.1 m-85 -100.65 145.65 28.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 112.71 -2.041 . . . . 0.0 110.449 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -64.34 -10.03 21.7 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.7 p -151.65 154.18 35.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.574 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.9 p -61.55 -33.68 58.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.327 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -63.43 -41.77 98.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.106 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.458 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 63.9 m -62.51 -28.03 69.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -51.8 9.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.778 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 120' ' ' SER . 0.1 OUTLIER -68.16 -19.19 64.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.403 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 4.9 m -82.76 -47.09 12.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.95 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.26 -25.04 66.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.779 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.8 t -85.68 -54.56 4.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.476 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 116' ' ' ARG . 3.2 m -80.41 4.42 18.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.088 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 117' ' ' SER . 35.6 t30 . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.53 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.48 ' HB3' HG12 ' A' ' 96' ' ' VAL . 50.3 Cg_exo -56.41 145.91 76.54 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.946 2.431 . . . . 0.0 112.782 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.79 126.5 51.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.321 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.8 126.28 41.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 111.314 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 116.49 17.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.259 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.29 -28.39 66.72 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.441 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.6 tpt -90.67 -58.23 2.55 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.554 ' HB3' HD11 ' A' ' 95' ' ' ILE . 10.3 m -83.94 -41.71 17.05 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.37 9.0 45.51 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.787 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.721 HG22 ' H ' ' A' ' 96' ' ' VAL . 1.5 mm -56.17 179.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.0 t -149.41 113.99 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.364 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.19 144.77 12.32 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.49 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 101' ' ' ALA . 4.6 p -62.75 138.71 58.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -31.43 -45.59 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -64.35 3.79 0.43 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 98' ' ' THR . . . -134.14 20.91 3.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.702 0.287 . . . . 0.0 110.914 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -132.06 155.28 48.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.022 0.439 . . . . 0.0 111.575 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.425 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.0 t80 -44.5 99.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.935 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.53 -27.18 15.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.927 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.425 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 6.8 tptp -47.8 -59.29 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 111.022 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.1 p -122.48 -33.96 3.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.94 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.18 -4.59 2.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.445 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 21.8 mtp180 -83.88 -24.97 30.6 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.854 0.359 . . . . 0.0 110.757 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -126.93 138.91 53.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.37 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.4 p -63.16 -12.95 31.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -156.25 159.14 38.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.81 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.31 -33.41 63.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 178.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 t -57.54 -41.76 81.6 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.327 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.87 -21.26 63.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.308 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.8 t -79.88 -51.67 8.84 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.135 0.493 . . . . 0.0 110.143 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -67.79 -17.47 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.4 t -82.38 -52.37 6.97 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.686 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.429 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 5.6 t80 -60.32 -22.88 63.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.704 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.28 -43.4 11.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.205 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 38.7 m -82.85 -54.63 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 C--N 1.331 -0.235 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.414 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.6 mt-10 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.476 0.179 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 4.6 Cg_exo -74.46 148.15 37.49 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.703 2.269 . . . . 0.0 112.215 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.708 ' HB3' ' CE2' ' A' ' 102' ' ' PHE . . . -143.02 136.22 28.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.227 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.618 HG12 ' HA2' ' A' ' 94' ' ' GLY . 17.0 t -90.9 133.8 31.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 20.3 t -64.9 124.82 23.01 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.457 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -69.52 3.83 2.16 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -118.41 -52.17 2.38 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.577 0.703 . . . . 0.0 109.862 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.472 ' CB ' HD11 ' A' ' 95' ' ' ILE . 5.9 m -96.9 -48.28 5.5 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.862 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.618 ' HA2' HG12 ' A' ' 89' ' ' VAL . . . 111.8 6.58 24.63 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -176.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.778 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.1 mm -52.18 -177.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.778 ' H ' HG22 ' A' ' 95' ' ' ILE . 2.5 t -138.53 136.11 43.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.265 0.555 . . . . 0.0 111.17 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.25 162.29 29.45 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.76 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.468 ' OG1' ' HB2' ' A' ' 101' ' ' ALA . 7.2 p -73.48 148.38 43.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.508 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -47.14 -31.05 3.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.467 -178.883 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.472 ' N ' ' HG3' ' A' ' 99' ' ' ARG . 26.6 mt-10 -85.95 -38.82 17.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.468 ' HB2' ' OG1' ' A' ' 98' ' ' THR . . . -59.94 -23.76 63.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.708 ' CE2' ' HB3' ' A' ' 88' ' ' ALA . 6.9 m-85 -72.72 161.18 31.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.075 0.464 . . . . 0.0 111.822 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.547 ' CE2' HG23 ' A' ' 112' ' ' VAL . 6.4 t80 -58.44 102.21 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.211 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' NZ ' ' A' ' 107' ' ' LYS . 77.3 p -38.99 -29.48 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.085 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 21.9 tttt -50.04 -60.7 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.014 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.0 p -128.21 -24.44 3.13 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 102' ' ' PHE . 0.0 OUTLIER 70.19 21.58 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.678 0.275 . . . . 0.0 111.06 -179.473 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -110.46 -9.44 14.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.56 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.436 ' CD1' ' CB ' ' A' ' 115' ' ' SER . 35.5 m-85 -128.93 151.39 49.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.745 0.307 . . . . 0.0 110.854 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 4.0 p -61.26 -27.16 68.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 p -160.48 157.6 27.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.968 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.547 HG23 ' CE2' ' A' ' 103' ' ' PHE . 10.9 p -53.18 -31.49 17.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.014 0.435 . . . . 0.0 110.332 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.433 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 25.0 p -68.03 -47.79 67.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.44 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.58 -43.4 84.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.927 0.394 . . . . 0.0 110.254 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.436 ' CB ' ' CD1' ' A' ' 109' ' ' PHE . 47.1 p -57.25 -61.12 2.69 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.594 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 113' ' ' SER . 10.9 ptm180 -54.39 -25.74 26.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.108 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.31 -61.92 1.62 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.277 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.536 ' HD1' ' O ' ' A' ' 118' ' ' TYR . 0.9 OUTLIER -46.26 -43.94 15.99 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.094 0.473 . . . . 0.0 111.61 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.3 t -69.51 -53.73 17.68 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.693 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.7 m -69.07 0.16 5.0 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.644 0.259 . . . . 0.0 111.103 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 6.3 mm-40 . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.422 0.153 . . . . 0.0 110.671 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 17.2 Cg_exo -66.36 160.22 46.44 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.401 2.067 . . . . 0.0 112.423 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.793 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -136.47 141.45 43.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.216 179.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.449 ' HA ' HG22 ' A' ' 96' ' ' VAL . 21.4 t -110.46 126.38 67.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.848 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 50.5 t -86.57 85.52 7.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.369 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.453 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 6.7 mm-40 -46.21 -20.69 0.11 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -178.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.488 ' HB2' ' HB2' ' A' ' 118' ' ' TYR . 0.4 OUTLIER -82.95 -58.7 2.75 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.004 0.431 . . . . 0.0 111.325 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.439 ' HB2' HD12 ' A' ' 95' ' ' ILE . 34.0 m -88.99 -56.93 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.09 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 126.89 -10.37 7.06 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 93' ' ' CYS . 3.9 mt -52.2 155.37 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 88' ' ' ALA . 46.4 t -147.58 125.16 3.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.856 0.36 . . . . 0.0 111.67 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -145.04 -167.8 12.45 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.92 128.46 36.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.48 0.64 . . . . 0.0 111.072 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 101' ' ' ALA . 5.7 mtt180 -33.8 -66.12 0.17 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.311 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -47.31 -6.89 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' ARG . . . -94.96 -50.32 5.16 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.81 179.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -51.46 172.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.447 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.0 t80 -55.01 110.16 0.63 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.921 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.6 p -68.45 -24.84 64.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.4 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 4.5 mttt -55.58 -55.44 31.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.255 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.7 -37.43 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.107 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.29 10.77 7.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.343 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.401 ' O ' ' CD1' ' A' ' 109' ' ' PHE . 37.3 mtm180 -113.48 -3.62 13.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.452 ' CE1' ' HD1' ' A' ' 118' ' ' TYR . 40.6 m-85 -147.33 161.77 40.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.226 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 7.1 p -85.5 24.33 1.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.8 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER 174.15 -175.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.574 0.702 . . . . 0.0 112.409 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 113' ' ' SER . 7.1 p -91.24 -54.51 7.34 Favored 'Isoleucine or valine' 0 C--O 1.25 1.104 0 CA-C-N 114.7 -1.136 . . . . 0.0 109.953 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.56 ' N ' HG13 ' A' ' 112' ' ' VAL . 3.9 p -66.32 -27.41 67.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.493 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.2 t -63.47 -37.81 88.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.769 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 13.3 t -67.83 -67.19 0.48 Allowed 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -21.1 12.2 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.545 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 113' ' ' SER . 4.2 m -73.54 -58.33 3.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 92' ' ' MET . 8.4 t80 -48.22 -35.22 11.48 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.4 t -84.45 -62.65 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.421 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.4 m -58.43 -54.98 40.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.56 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.9 t30 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.08 -179.721 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.406 ' N ' ' HG3' ' A' ' 86' ' ' GLU . . . . . . . . 0 N--CA 1.488 2.147 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.81 -83.2 0.36 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.606 0.241 . . . . 0.0 111.371 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.48 -70.64 0.99 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.59 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.39 69.48 0.09 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.994 0.426 . . . . 0.0 110.65 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 82' ' ' GLY . 4.8 mm-40 -54.29 140.95 53.55 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.998 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 97.3 Cg_endo -84.81 132.33 4.73 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.624 2.216 . . . . 0.0 112.775 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -119.23 102.17 8.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.887 HG13 HG22 ' A' ' 96' ' ' VAL . 11.0 t -79.08 138.28 20.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.788 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -84.2 120.48 26.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.539 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -69.19 -20.54 63.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.838 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.5 -58.26 2.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.767 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.3 m -91.44 -29.68 16.91 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.39 -19.49 53.63 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.574 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.7 mt -54.44 134.36 17.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.815 0.34 . . . . 0.0 111.449 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.887 HG22 HG13 ' A' ' 89' ' ' VAL . 12.8 t -114.93 141.71 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.48 -173.4 20.62 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.978 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 p -89.78 142.65 27.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.75 -42.56 5.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -1.84 16.66 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.41 -28.02 7.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.317 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 0.8 OUTLIER -87.56 160.41 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 111.451 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.93 110.43 0.23 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.347 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.2 m -62.58 -27.31 69.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.397 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 1.1 ttmt -50.76 -60.28 3.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.801 0.334 . . . . 0.0 111.166 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.408 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.6 p -116.96 -40.37 3.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.71 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.423 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 82.93 -21.6 0.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.653 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -68.22 -32.38 72.55 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 25.9 m-85 -119.49 142.97 47.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -66.26 -11.22 48.94 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -152.85 155.27 36.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.887 0.375 . . . . 0.0 111.662 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.434 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -63.22 -34.06 64.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.065 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 82.5 p -58.94 -44.31 91.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.926 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 54.9 m -58.69 -24.6 61.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.534 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.82 -50.75 10.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.797 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -69.36 -19.28 63.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.407 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 1.4 m -82.1 -51.51 7.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.082 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.0 -26.0 68.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.85 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.37 -46.11 9.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.307 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.02 0.7 54.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.277 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 117' ' ' SER . 55.0 t30 -134.39 0.45 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.13 -168.82 1.5 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.147 0.498 . . . . 0.0 111.735 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -162.93 150.79 13.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.926 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.896 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.445 -0.262 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.9 p -49.74 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.781 0.324 . . . . 0.0 111.177 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 47.61 -109.93 0.53 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.745 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.442 ' OG ' HG21 ' A' ' 98' ' ' THR . 0.1 OUTLIER -144.59 45.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.897 0.379 . . . . 0.0 110.841 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.8 mm-40 -57.47 116.93 15.47 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.017 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 15.8 Cg_exo -68.38 136.81 37.99 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.58 2.186 . . . . 0.0 112.43 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.97 116.31 22.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.876 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 96' ' ' VAL . 19.6 t -81.49 136.53 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.534 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -80.07 119.86 23.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.271 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.35 -22.6 66.83 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 2.9 tpt -91.21 -58.26 2.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.06 -29.83 19.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 98.41 -22.04 42.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.266 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.5 mm -54.79 136.34 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.961 0.41 . . . . 0.0 111.085 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 89' ' ' VAL . 6.5 t -108.03 139.9 28.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.889 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.465 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.7 158.52 27.72 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.299 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.442 HG21 ' OG ' ' A' ' 85' ' ' SER . 41.2 p -68.99 143.68 54.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.83 0.315 . . . . 0.0 110.399 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -44.84 -41.92 7.47 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.91 -4.37 27.87 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.92 -27.32 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.303 . . . . 0.0 111.122 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -88.28 158.95 18.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.26 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.82 118.57 1.66 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.205 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 26.7 t -65.52 -27.0 68.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.542 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.455 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 16.4 tptp -52.32 -49.07 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 7.4 p -128.12 -42.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.335 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 22.9 mmtm 84.79 -20.88 0.27 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.455 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -75.33 -25.0 57.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.866 0.365 . . . . 0.0 110.616 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.418 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 45.6 m-85 -120.75 133.34 55.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.175 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.5 p -63.02 -12.75 28.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -151.62 153.78 35.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.004 0.43 . . . . 0.0 111.884 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.0 p -60.95 -35.49 65.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.045 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.5 t -59.62 -40.77 88.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.773 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 8.5 m -60.8 -27.66 68.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.224 179.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 t -74.73 -53.82 8.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.878 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -70.55 -17.58 62.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.59 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.1 m -81.83 -49.24 10.6 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.419 ' CE2' ' O ' ' A' ' 124' ' ' LYS . 1.2 t80 -67.6 -25.25 65.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.778 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -83.93 -50.85 7.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.246 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.0 t -61.15 -51.43 69.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.18 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -88.76 -69.94 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.671 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 68.14 18.34 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.99 4.19 45.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.686 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.419 ' O ' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.901 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.15 -70.75 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 111.067 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 61.92 69.76 1.22 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.529 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m 47.37 60.15 3.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.791 0.329 . . . . 0.0 111.401 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.23 142.03 86.54 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.201 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.33 131.3 3.53 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.887 2.392 . . . . 0.0 112.759 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -116.78 106.65 13.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.906 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.718 HG13 HG22 ' A' ' 96' ' ' VAL . 4.7 t -82.06 126.31 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.416 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.33 122.45 22.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.414 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -66.3 -22.15 66.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.78 -58.23 2.55 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 m -86.13 -33.39 20.9 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.18 16.91 54.95 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.425 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.72 132.87 34.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.423 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.718 HG22 HG13 ' A' ' 89' ' ' VAL . 3.5 t -108.77 135.93 46.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.382 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.36 171.49 30.24 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.288 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 39.0 p -72.45 137.6 46.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.573 0.225 . . . . 0.0 110.581 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.403 ' HG2' ' HG2' ' A' ' 107' ' ' LYS . 20.0 mtp180 -43.27 -40.94 3.72 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.27 0.23 6.79 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -118.97 -19.15 8.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.646 0.26 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.457 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.5 m-85 -93.38 158.84 15.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.154 0.502 . . . . 0.0 111.745 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 105' ' ' LYS . 2.7 t80 -44.63 111.68 0.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.32 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 69.6 m -64.26 -31.16 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.426 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.453 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -49.63 -57.29 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.221 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.572 HG22 ' NE ' ' A' ' 108' ' ' ARG . 0.2 OUTLIER -113.79 -46.1 3.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 85.33 -26.09 0.11 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.424 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.572 ' NE ' HG22 ' A' ' 106' ' ' THR . 14.1 mtm180 -69.86 -32.99 71.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.875 0.369 . . . . 0.0 110.597 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.4 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 22.8 m-85 -118.25 138.48 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.437 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 29.5 p -63.12 -13.73 40.04 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.7 p -150.55 152.96 34.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.975 0.417 . . . . 0.0 111.739 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.408 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.79 -33.75 61.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.991 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 8.0 t -60.7 -37.97 83.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.803 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 58.1 m -62.87 -24.7 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.162 179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -50.24 10.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -70.53 -19.52 62.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.398 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 11.3 t -80.98 -51.17 8.82 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.802 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -63.69 -26.01 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.65 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.47 -43.36 11.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.438 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -87.56 -0.34 56.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.395 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -138.7 2.07 2.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.8 171.57 19.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 111.894 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -171.74 153.76 3.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.995 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.868 179.802 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 t -162.36 141.43 9.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 110.892 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.6 -89.84 0.94 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.516 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.0 p -157.35 60.35 0.5 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.937 0.398 . . . . 0.0 110.795 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -55.53 143.2 58.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.182 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.2 Cg_endo -86.53 131.15 3.38 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.885 2.39 . . . . 0.0 112.88 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.817 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -108.89 164.63 12.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.787 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 20.7 t -138.13 126.28 30.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.498 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -73.85 108.88 6.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.076 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.42 ' HG2' ' CZ ' ' A' ' 118' ' ' TYR . 1.9 tp10 -55.26 -19.18 7.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.304 -178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.2 tpt -100.29 -58.68 1.85 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -178.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.83 -30.89 40.52 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 94.09 -21.0 44.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.454 -0.879 . . . . 0.0 112.431 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 33.5 mm -52.49 133.71 14.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.528 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.817 HG13 ' O ' ' A' ' 88' ' ' ALA . 16.4 t -110.43 140.86 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.252 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.33 -167.79 14.74 Favored Glycine 0 C--O 1.227 -0.298 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.802 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 70.4 p -98.38 142.16 30.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.969 0.384 . . . . 0.0 110.339 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HG2' ' NZ ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.65 -42.53 7.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.08 -1.13 16.12 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.06 -31.29 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.862 0.363 . . . . 0.0 111.091 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -81.26 161.12 24.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.334 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.466 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 1.2 t80 -44.69 118.08 1.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.139 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.8 m -71.95 -29.27 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.588 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.466 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 19.5 tptp -57.84 -38.71 76.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.43 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 44.1 p -128.21 -48.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 11.6 mmtp 84.09 -31.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 55.9 mtm180 -62.09 -46.99 86.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.837 0.351 . . . . 0.0 110.28 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -105.17 143.28 33.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.474 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 30.7 p -66.72 -11.01 52.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -154.06 156.44 37.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.938 0.399 . . . . 0.0 111.689 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.8 p -64.93 -33.73 65.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.91 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 0.2 OUTLIER -58.03 -45.47 86.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.838 179.142 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 95.4 m -59.33 -24.48 63.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.334 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.6 t -76.1 -50.17 15.39 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.726 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -70.39 -21.54 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.491 179.257 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -49.27 12.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.886 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 91' ' ' GLU . 1.7 t80 -65.87 -25.88 67.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.873 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.0 p -88.01 -40.06 14.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.132 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 1.1 t -90.43 -4.09 57.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.845 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -140.36 35.55 1.87 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.684 0.278 . . . . 0.0 111.3 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.98 -39.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.147 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -73.12 -64.13 1.04 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.865 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.852 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.441 ' O ' ' CB ' ' A' ' 83' ' ' SER . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 82' ' ' GLY . 4.6 t 84.57 -65.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.728 0.299 . . . . 0.0 110.934 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 53.32 62.05 6.38 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.824 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 m 54.1 48.22 21.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.787 0.327 . . . . 0.0 111.301 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 0.3 OUTLIER -54.85 129.46 65.22 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_exo -65.06 126.45 16.49 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.551 2.167 . . . . 0.0 112.697 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -118.0 102.51 9.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.783 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.845 HG13 HG22 ' A' ' 96' ' ' VAL . 7.3 t -79.24 132.74 31.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.432 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 32.2 t -80.41 121.7 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.582 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -69.39 -20.2 63.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.775 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 7.8 tpt -89.52 -58.2 2.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 6.6 m -89.15 -31.7 17.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.09 17.96 51.82 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.523 -0.846 . . . . 0.0 112.473 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mm -91.77 134.05 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.384 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.845 HG22 HG13 ' A' ' 89' ' ' VAL . 3.2 t -109.92 137.51 41.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.182 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.54 -178.05 25.04 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.983 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.7 p -81.87 136.74 35.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.789 0.294 . . . . 0.0 110.249 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mtp180 -43.2 -38.42 2.5 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.64 3.83 3.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.17 -21.05 6.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.688 0.28 . . . . 0.0 111.435 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.8 m-85 -91.07 160.71 15.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.09 0.471 . . . . 0.0 111.504 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.493 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.57 108.23 0.11 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.096 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 t -57.54 -42.54 83.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.842 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.493 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 2.8 mmpp? -46.5 -60.29 2.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.45 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -102.52 -52.41 3.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.048 -179.827 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.454 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 86.57 -27.31 0.08 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.507 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.94 -32.57 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.9 0.381 . . . . 0.0 110.72 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -117.4 144.41 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.644 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.3 p -66.08 -11.36 48.15 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.9 p -154.87 157.38 37.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.902 0.382 . . . . 0.0 111.644 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.4 p -65.29 -34.77 72.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.978 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.408 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 62.3 p -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.736 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.71 -22.04 63.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.389 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.88 -48.39 11.59 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 2.4 ptp180 -70.72 -20.59 62.64 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 5.0 t -78.95 -50.7 10.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.465 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 1.9 t80 -63.95 -24.17 67.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.529 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.5 p -88.19 -34.39 17.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.805 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 66.4 m -93.81 -6.17 46.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.013 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 58.6 m-80 -137.3 13.57 3.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.465 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -152.6 120.69 6.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.994 0.426 . . . . 0.0 111.202 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 176.9 158.74 0.34 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.798 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.62 -172.88 0.23 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 0.0 110.817 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.04 -85.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.404 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 50.19 1.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 0.0 110.84 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.67 141.1 46.77 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.155 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 89.1 Cg_endo -85.73 131.58 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.791 2.327 . . . . 0.0 112.792 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.725 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.81 99.52 7.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.306 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 96' ' ' VAL . 38.5 t -79.08 126.27 38.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.434 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.16 115.22 10.05 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 109' ' ' PHE . 2.4 tt0 -71.59 -21.24 61.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.704 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -13.26 23.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.441 ' HB2' HD12 ' A' ' 95' ' ' ILE . 55.8 m -132.05 -43.69 0.96 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 118.131 0.423 . . . . 0.0 111.666 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 119.35 -32.48 5.05 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.441 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.5 mp -52.54 132.33 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.84 0.352 . . . . 0.0 111.855 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.689 HG22 HG13 ' A' ' 89' ' ' VAL . 10.9 t -115.55 141.77 31.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.704 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -176.73 23.71 Favored Glycine 0 C--O 1.228 -0.273 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.116 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.9 p -86.99 142.19 28.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.791 0.296 . . . . 0.0 110.292 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.53 -41.56 2.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.167 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.95 -1.58 10.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.04 -17.62 8.95 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 2.2 m-85 -97.2 159.05 15.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.022 0.439 . . . . 0.0 111.669 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.482 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 4.7 t80 -44.93 113.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.9 t -59.91 -39.53 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.776 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -46.68 -60.31 2.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.81 0.338 . . . . 0.0 111.568 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.435 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 22.5 p -106.61 -52.16 2.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.725 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 84.77 -23.07 0.18 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.461 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.0 -27.93 60.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.686 0.279 . . . . 0.0 110.922 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 32.1 m-85 -119.52 137.41 53.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.465 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.414 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 26.9 p -57.68 -15.01 6.49 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.0 p -152.24 154.56 36.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.997 0.427 . . . . 0.0 112.001 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.454 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -63.26 -35.82 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.023 178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.6 p -57.85 -38.97 76.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.614 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.9 m -60.93 -24.41 66.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.347 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 -51.14 10.01 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 ptp85 -70.36 -17.58 63.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.321 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 122' ' ' SER . 2.3 m -83.94 -50.06 8.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.14 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.85 -24.04 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.864 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.1 t -88.11 -49.34 7.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.931 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 2.0 t -77.9 -58.31 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.995 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -93.28 -81.14 0.37 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 117' ' ' SER . 0.2 OUTLIER 167.86 -173.57 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.579 -179.665 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -61.88 -89.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.767 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.911 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.461 -0.256 . . . . 0.0 112.461 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.404 ' O ' ' N ' ' A' ' 85' ' ' SER . 3.0 p -126.02 138.1 53.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 111.165 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.65 77.71 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.388 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.456 ' N ' ' HD3' ' A' ' 99' ' ' ARG . 16.3 t 172.04 39.28 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.007 0.432 . . . . 0.0 109.998 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -96.51 161.99 24.91 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.231 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.27 135.21 22.22 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.019 2.479 . . . . 0.0 112.613 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.57 123.02 39.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.638 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.533 HG13 HG22 ' A' ' 96' ' ' VAL . 13.7 t -80.31 144.19 11.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.67 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 48.7 t -90.06 119.79 30.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.476 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -64.23 -23.52 67.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.841 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -91.61 -58.17 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.0 -29.33 19.57 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.77 -23.18 37.11 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.978 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.6 mm -53.9 137.12 14.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.933 0.397 . . . . 0.0 111.059 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.533 HG22 HG13 ' A' ' 89' ' ' VAL . 6.2 t -108.53 138.44 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.704 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.72 150.86 22.92 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.086 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.0 p -57.61 138.62 55.11 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.456 ' HD3' ' N ' ' A' ' 85' ' ' SER . 2.6 ptm180 -46.52 -36.52 6.82 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -70.26 0.67 5.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.55 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.58 -19.41 7.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.318 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -92.08 158.07 16.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 105' ' ' LYS . 2.2 t80 -45.2 115.35 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.113 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 33.4 p -62.8 -28.9 70.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.555 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HB3' ' CD2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -54.12 -60.5 3.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 0.0 111.187 -179.602 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.442 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.6 OUTLIER -107.34 -46.25 3.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.078 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.97 -26.68 0.1 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.515 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 7.5 mtm-85 -71.97 -23.05 61.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 91' ' ' GLU . 24.7 m-85 -121.58 140.72 51.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.6 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.2 p -66.94 -12.14 58.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.46 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.5 p -152.91 154.85 35.88 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.441 . . . . 0.0 112.059 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.448 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -62.91 -35.57 71.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.911 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.2 p -58.21 -40.63 82.13 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.792 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.56 -24.53 65.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.406 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -79.91 -49.36 12.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -20.66 62.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.408 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 5.6 m -80.25 -52.02 8.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.782 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.492 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 1.4 t80 -63.7 -25.89 68.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.715 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -88.69 -42.86 11.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.429 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.6 t -88.71 -2.02 58.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.247 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -139.82 0.95 1.84 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.492 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -148.78 153.52 38.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.141 0.496 . . . . 0.0 111.664 -179.811 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt 51.39 70.67 0.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.87 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.0 t 67.41 153.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.795 0.331 . . . . 0.0 110.829 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.35 21.69 31.54 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.542 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.1 p -145.0 46.15 1.34 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.877 0.37 . . . . 0.0 110.639 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.11 116.95 25.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.919 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -61.52 133.03 43.53 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.51 2.14 . . . . 0.0 112.442 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -121.84 114.24 20.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.545 HG13 HG22 ' A' ' 96' ' ' VAL . 19.7 t -78.99 135.27 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.432 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 38.6 t -80.97 120.18 24.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.744 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.456 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -67.43 -21.39 65.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.971 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -58.32 2.53 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.3 m -90.85 -27.72 18.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.46 -19.91 52.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.485 -0.865 . . . . 0.0 112.146 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.3 mm -57.76 142.16 13.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.987 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.545 HG22 HG13 ' A' ' 89' ' ' VAL . 4.3 t -115.67 142.91 26.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.952 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.34 161.03 28.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.112 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 71.1 p -69.26 140.11 54.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.447 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 12.5 ptm180 -41.58 -41.25 2.11 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -71.31 0.66 7.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.94 -21.15 6.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.577 0.227 . . . . 0.0 111.594 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -92.64 161.25 14.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.933 0.397 . . . . 0.0 111.33 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.463 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 3.3 t80 -44.65 100.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.082 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.9 m -55.98 -25.01 42.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.731 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.463 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 1.1 tptp -54.4 -59.83 4.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 111.044 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.437 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.0 OUTLIER -117.19 -40.64 3.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.84 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 84.32 -17.52 0.46 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.663 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -61.68 -46.09 91.23 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.781 0.324 . . . . 0.0 110.588 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 9.0 m-85 -108.44 160.26 16.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.55 -5.78 49.09 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -161.6 164.33 29.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.098 0.475 . . . . 0.0 112.062 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 113' ' ' SER . 9.2 p -66.6 -44.58 89.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.299 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 112' ' ' VAL . 55.1 p -57.94 -36.11 72.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.853 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -67.23 -18.96 65.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.498 178.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 7.0 p -85.88 -46.73 10.32 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.623 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -74.78 -20.74 59.68 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.527 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 39.6 m -81.32 -53.63 6.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.52 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.456 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 15.7 t80 -67.15 -20.06 65.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.149 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -88.23 -49.86 6.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.203 0.525 . . . . 0.0 110.894 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 t -80.22 6.3 12.21 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.761 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.527 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.2 m-80 -101.2 12.78 36.91 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.825 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.1 t 58.76 77.76 0.29 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.824 0.345 . . . . 0.0 110.784 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -64.88 -76.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.909 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.3 tttm . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.963 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.4 163.89 1.64 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 69.19 71.56 0.97 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.532 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 p 42.94 68.95 0.43 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.765 0.317 . . . . 0.0 111.671 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -60.17 142.94 89.31 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.757 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.9 Cg_endo -82.25 128.62 5.66 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.76 2.307 . . . . 0.0 113.277 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.822 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -106.5 169.85 8.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.814 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -139.29 126.32 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.84 0.352 . . . . 0.0 111.908 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 35.5 t -78.51 114.63 17.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.399 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -63.68 -18.63 64.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.244 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.5 tpt -94.38 -58.37 2.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.7 m -88.18 -25.37 22.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.13 22.13 61.54 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.385 -0.912 . . . . 0.0 112.24 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.9 mm -89.69 128.45 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.79 0.328 . . . . 0.0 110.479 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.822 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.1 t -103.65 134.56 44.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.15 -169.1 15.89 Favored Glycine 0 C--O 1.228 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.122 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.7 p -95.3 137.25 34.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.436 ' HG2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -43.58 -40.46 4.04 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.8 3.39 8.15 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.02 -28.61 4.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 111.436 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 0.4 OUTLIER -79.09 161.53 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 111.82 -179.407 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 2.3 t80 -44.67 106.4 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.237 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 47.5 m -62.94 -25.43 68.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.536 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -51.49 -60.39 3.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.778 0.323 . . . . 0.0 111.139 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.441 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.2 p -113.5 -36.76 4.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.441 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.57 -34.25 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.494 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.59 -51.06 68.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.819 0.342 . . . . 0.0 110.685 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -101.93 140.71 35.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.652 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 31.3 p -64.18 -14.45 55.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 112.31 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.1 p -151.67 154.22 35.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.842 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.429 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -63.16 -32.77 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.746 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' ARG . 4.2 t -57.74 -44.69 86.21 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.741 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 65.2 m -59.65 -27.67 66.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.171 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 t -72.12 -55.29 7.56 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.978 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -69.28 -18.1 63.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.907 0.384 . . . . 0.0 110.122 178.816 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 1.8 m -79.55 -54.02 6.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -61.17 -24.77 66.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.079 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.8 t -83.23 -52.93 6.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.512 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -50.9 8.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 37.8 t30 -67.15 -5.16 12.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 49.7 m 50.44 87.14 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.65 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.442 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.2 tttt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.913 -179.851 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.409 ' HA2' ' CG ' ' A' ' 86' ' ' GLU . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -148.16 -70.02 0.22 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.731 0.301 . . . . 0.0 111.502 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -45.09 -72.25 0.39 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.221 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -174.69 78.22 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.843 0.354 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 3.5 mm-40 -50.9 134.84 28.29 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.374 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 6.2 Cg_exo -77.86 131.54 11.22 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.359 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -120.35 98.93 6.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.69 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.801 HG13 HG22 ' A' ' 96' ' ' VAL . 11.6 t -79.74 133.76 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.249 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -78.08 118.66 20.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.646 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.5 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 7.1 mm-40 -65.79 -20.51 66.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.852 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -58.23 2.47 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.479 ' HB2' HD13 ' A' ' 95' ' ' ILE . 5.7 m -88.58 -31.89 18.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.05 19.28 43.42 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.865 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.479 HD13 ' HB2' ' A' ' 93' ' ' CYS . 3.2 mp -89.96 128.39 41.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.116 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.801 HG22 HG13 ' A' ' 89' ' ' VAL . 4.8 t -103.71 137.3 32.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.253 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.51 -174.96 22.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.766 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 p -90.49 143.17 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.952 0.376 . . . . 0.0 110.333 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 6.7 ptm180 -43.96 -42.23 5.8 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -71.67 0.01 9.79 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.91 -28.27 7.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 111.321 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.405 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 1.5 m-85 -87.96 160.08 18.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.2 t80 -44.98 105.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.4 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.4 p -57.43 -26.4 61.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.435 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -53.62 -60.04 3.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.163 -179.795 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.431 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.3 p -115.1 -43.55 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 83.57 -21.32 0.28 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.498 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -67.69 -34.07 76.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.74 0.305 . . . . 0.0 110.834 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.486 ' CE2' ' CD2' ' A' ' 118' ' ' TYR . 19.2 m-85 -118.42 148.22 42.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.502 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.405 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 14.9 p -66.83 -7.6 22.72 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.4 p -163.31 166.16 23.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.928 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 113' ' ' SER . 10.6 p -66.66 -46.19 86.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.453 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.496 ' N ' HG13 ' A' ' 112' ' ' VAL . 11.5 p -56.99 -39.69 75.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.14 0.495 . . . . 0.0 109.815 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 1.6 t -63.71 -18.91 64.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.478 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.1 t -85.56 -47.17 10.13 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -73.24 -19.73 61.01 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 8.4 t -82.19 -53.38 6.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.476 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.5 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 14.4 t80 -65.19 -20.45 66.45 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.141 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.4 t -87.99 -50.37 6.46 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.488 . . . . 0.0 110.632 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.3 m -81.48 3.61 24.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.071 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.4 m-20 -89.36 -1.11 57.94 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 54.99 77.31 0.22 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.907 0.384 . . . . 0.0 110.812 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -63.6 -46.33 86.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.174 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.009 -179.83 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -168.1 149.91 5.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.881 0.372 . . . . 0.0 110.947 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.96 -177.91 38.85 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.982 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 77.36 -34.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -47.59 128.3 10.65 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.93 136.9 3.74 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.979 2.452 . . . . 0.0 112.427 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.73 108.25 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.731 HG13 HG22 ' A' ' 96' ' ' VAL . 9.8 t -81.62 128.08 39.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -75.43 120.43 20.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.535 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.454 ' HG2' ' CE1' ' A' ' 118' ' ' TYR . 1.5 tt0 -68.28 -17.77 64.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.719 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 9.6 tpt -92.62 -58.14 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.9 m -88.18 -31.99 18.83 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 -178.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.73 19.01 49.87 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.254 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -93.82 132.98 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 120.951 0.405 . . . . 0.0 110.063 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.731 HG22 HG13 ' A' ' 89' ' ' VAL . 2.9 t -105.04 133.47 49.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.387 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.57 151.59 23.59 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.833 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.6 p -59.14 140.31 56.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.019 0.41 . . . . 0.0 110.604 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.402 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 32.2 ptt85 -44.56 -33.9 1.93 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.24 -0.436 . . . . 0.0 112.007 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -68.13 -2.9 8.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.07 -1.13 7.77 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -109.55 158.06 18.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.178 0.513 . . . . 0.0 111.73 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.472 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 3.9 t80 -44.43 100.59 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.178 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.4 OUTLIER -49.87 -28.39 6.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.884 -179.336 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -50.44 -54.64 20.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.848 0.356 . . . . 0.0 111.216 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 2.1 p -128.01 -38.01 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.147 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 8.3 mmtp 81.27 -9.52 1.29 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.535 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -68.85 -34.29 75.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.601 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -118.35 143.74 46.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.1 p -63.7 -13.09 40.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -155.8 158.27 37.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.988 0.423 . . . . 0.0 111.907 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.4 p -65.73 -36.06 76.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.837 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 60.7 p -58.15 -39.2 78.2 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.568 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.67 -21.58 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.367 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.6 p -82.34 -48.41 11.19 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.673 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.401 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 27.5 ptt180 -71.95 -19.68 61.86 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.422 ' O ' ' N ' ' A' ' 121' ' ' ASN . 4.0 m -79.06 -51.88 8.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.458 ' CD2' ' HB3' ' A' ' 122' ' ' SER . 1.9 t80 -63.56 -23.58 67.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.554 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 16.6 p -88.37 -35.74 16.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.739 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -92.59 -6.16 50.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.981 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 117' ' ' SER . 71.3 m-80 -134.64 5.34 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.458 ' HB3' ' CD2' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -145.78 129.63 17.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.913 0.387 . . . . 0.0 111.027 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.23 146.14 30.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.875 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.862 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -76.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 58.25 -148.46 36.98 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.539 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.41 ' HA ' ' NE ' ' A' ' 99' ' ' ARG . 21.7 p -134.02 46.91 2.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 0.0 110.771 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.13 146.75 33.32 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.408 ' HB2' ' CG1' ' A' ' 96' ' ' VAL . 92.2 Cg_endo -85.24 149.47 10.48 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.865 2.377 . . . . 0.0 112.546 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.455 ' C ' HG13 ' A' ' 96' ' ' VAL . . . -124.71 120.9 33.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.955 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.513 HG22 ' CG2' ' A' ' 96' ' ' VAL . 22.0 t -79.11 137.74 21.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.624 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 39.0 t -81.16 114.9 20.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.96 -22.1 62.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -95.9 -58.31 2.13 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.595 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.4 m -89.29 -28.98 19.51 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.12 -24.32 32.32 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.474 -179.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 93' ' ' CYS . 4.5 mp -52.71 138.1 11.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.914 0.388 . . . . 0.0 111.01 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.513 ' CG2' HG22 ' A' ' 89' ' ' VAL . 8.7 t -113.33 141.3 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.666 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.404 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.73 156.12 26.52 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.116 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.6 p -65.8 142.71 57.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.516 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -44.41 -34.96 2.2 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.442 ' N ' ' HG2' ' A' ' 99' ' ' ARG . 2.7 tp10 -74.17 -0.68 17.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.24 -18.9 7.25 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.404 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.5 m-85 -91.97 161.38 14.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.49 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.7 97.28 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.203 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.421 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 9.0 t -47.74 -28.88 2.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.064 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 0.8 OUTLIER -54.43 -60.42 3.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 p -119.64 -39.25 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 81.64 -14.15 0.82 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.719 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -64.19 -39.34 93.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.758 0.313 . . . . 0.0 110.549 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 115' ' ' SER . 11.5 m-85 -112.07 153.51 26.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.386 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.5 p -68.39 -7.69 33.72 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -165.53 168.41 16.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.051 0.453 . . . . 0.0 111.94 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.466 HG13 ' N ' ' A' ' 113' ' ' SER . 10.2 p -68.12 -43.27 85.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.237 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.466 ' N ' HG13 ' A' ' 112' ' ' VAL . 16.6 t -57.66 -40.61 79.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.8 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.34 -19.06 65.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.563 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.435 ' HA ' ' CD1' ' A' ' 109' ' ' PHE . 4.9 p -84.29 -45.35 12.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.53 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -74.21 -19.84 60.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.848 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.8 t -80.81 -53.88 6.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.584 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.404 ' HD1' ' CZ ' ' A' ' 109' ' ' PHE . 10.1 t80 -66.72 -22.39 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.999 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 t -88.31 -48.78 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.917 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.6 m -81.12 2.88 25.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.146 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -140.16 -0.2 1.66 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.94 155.58 43.5 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.871 0.367 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.02 146.17 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.931 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.291 -0.861 . . . . 0.0 111.017 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 112.584 -0.207 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -75.11 -76.62 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.881 0.372 . . . . 0.0 110.758 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.89 129.14 1.88 Allowed Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.4 t 63.06 50.44 3.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.143 0.497 . . . . 0.0 109.689 -178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.12 162.33 75.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.448 -179.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 85.1 Cg_endo -84.94 128.42 3.75 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.857 2.371 . . . . 0.0 112.79 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.787 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -110.02 167.3 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.571 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.1 t -137.95 126.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.591 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.73 110.53 8.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.495 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 6.5 mp0 -58.38 -21.13 49.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.2 tpt -96.9 -58.52 2.01 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -82.96 -27.85 30.2 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.6 20.89 60.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.095 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -88.72 129.07 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.0 t -104.93 136.35 38.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 111.328 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -169.68 16.73 Favored Glycine 0 C--O 1.227 -0.289 0 N-CA-C 111.736 -0.546 . . . . 0.0 111.736 179.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.6 p -91.43 136.65 32.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.083 0.441 . . . . 0.0 110.137 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.46 ' HA ' ' CE ' ' A' ' 107' ' ' LYS . 20.7 mtp85 -42.9 -38.43 2.19 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.66 9.19 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.76 -34.66 4.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.999 0.428 . . . . 0.0 110.856 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -74.09 161.4 30.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 112.075 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 107' ' ' LYS . 4.6 t80 -44.34 152.16 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.886 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.1 m -96.16 -46.2 6.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.315 . . . . 0.0 111.559 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -47.8 -49.52 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -179.299 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.404 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 74.1 p -105.29 -49.0 3.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.33 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 103' ' ' PHE . 0.1 OUTLIER 82.95 -46.73 0.14 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.157 -179.632 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -60.88 -45.28 95.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.984 0.421 . . . . 0.0 110.487 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -96.88 145.38 25.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -68.73 -9.65 51.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -155.96 158.41 37.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.956 0.408 . . . . 0.0 111.757 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.452 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.0 p -63.96 -36.48 76.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.896 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.4 t -57.27 -44.05 83.63 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.731 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.7 m -60.0 -26.13 65.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.017 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 p -73.46 -52.21 14.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -69.55 -20.81 63.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.245 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.85 -53.1 7.44 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.996 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.495 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.8 t80 -63.74 -25.15 68.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.987 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.5 t -81.26 -55.48 4.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.6 m -79.44 -52.42 8.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.47 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.17 -0.86 20.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.737 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 m 56.5 -158.91 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.711 0.291 . . . . 0.0 111.346 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.422 ' HD2' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -125.99 110.48 13.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.897 -179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.5 tptt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.941 179.894 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 97.4 p -50.86 -69.15 0.12 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.724 0.297 . . . . 0.0 111.574 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -101.68 71.32 0.37 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.361 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 46.87 59.32 4.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.924 0.393 . . . . 0.0 111.483 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -65.97 122.61 81.91 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.053 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.27 129.69 29.35 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.46 2.107 . . . . 0.0 112.661 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.93 109.7 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.615 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.711 HG13 HG22 ' A' ' 96' ' ' VAL . 11.3 t -82.29 131.71 33.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.834 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 45.1 t -79.43 119.81 22.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.44 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.477 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.2 mt-10 -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.1 tpt -88.52 -58.26 2.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 11.7 m -86.96 -35.6 18.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.679 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.99 -26.45 23.09 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.102 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -52.61 132.6 14.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 111.229 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.711 HG22 HG13 ' A' ' 89' ' ' VAL . 11.7 t -106.67 139.05 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.242 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.452 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.24 151.56 23.59 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 72.2 p -61.34 140.0 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.571 0.224 . . . . 0.0 110.895 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -39.85 -45.46 1.81 Allowed 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.04 -1.15 3.8 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.42 -10.66 9.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.63 0.252 . . . . 0.0 111.371 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.452 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.6 m-85 -105.45 159.09 16.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.208 0.527 . . . . 0.0 111.41 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.459 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 5.1 t80 -44.63 104.43 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.185 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.2 m -54.43 -35.29 62.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.875 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.459 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 0.3 OUTLIER -47.92 -60.36 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.728 0.299 . . . . 0.0 111.434 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.518 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 33.0 p -111.0 -46.39 3.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.717 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 106' ' ' THR . 6.4 mmtp 80.33 -15.67 0.73 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.841 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -74.56 -27.59 60.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.908 0.385 . . . . 0.0 110.394 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -123.54 140.0 53.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.516 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 25.1 p -60.16 -13.79 14.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.2 p -151.74 154.41 36.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.918 0.39 . . . . 0.0 111.859 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.56 -36.27 74.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 8.8 t -58.67 -40.08 82.51 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.733 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 118' ' ' TYR . 9.9 m -61.77 -23.76 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.303 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.3 p -79.33 -52.94 7.44 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.763 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 113' ' ' SER . 16.4 ptt-85 -70.05 -17.66 63.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.281 178.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.6 m -82.79 -47.95 11.34 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.819 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.5 t80 -69.89 -21.59 63.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.934 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 p -88.18 -60.49 1.95 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.506 ' C ' ' H ' ' A' ' 122' ' ' SER . 42.6 m -57.83 -44.03 86.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.035 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -70.31 22.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.506 ' H ' ' C ' ' A' ' 120' ' ' SER . 0.3 OUTLIER 46.66 90.27 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 179.465 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.3 -44.33 92.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.511 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.964 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.414 -0.275 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.71 -37.36 3.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.85 0.357 . . . . 0.0 111.024 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 53.02 38.37 55.54 Favored Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.745 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.84 97.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.565 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.84 117.02 66.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.006 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.579 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 34.5 Cg_exo -60.76 124.12 14.36 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.556 2.171 . . . . 0.0 112.21 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.41 ' O ' ' CE2' ' A' ' 102' ' ' PHE . . . -110.32 100.97 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 95' ' ' ILE . 16.7 t -79.11 140.19 17.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.914 0.388 . . . . 0.0 111.479 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.15 121.54 19.47 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -76.14 11.45 1.49 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.361 -0.836 . . . . 0.0 113.073 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.7 tpt -116.52 -55.23 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.454 ' HB2' ' CD1' ' A' ' 95' ' ' ILE . 6.4 m -96.06 -47.7 5.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.429 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 114.35 6.33 20.15 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.762 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.0 mm -52.35 -177.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.762 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.2 t -142.67 142.41 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-O 121.306 0.574 . . . . 0.0 111.571 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.99 -167.91 15.14 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.115 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.47 ' OG1' ' HB3' ' A' ' 101' ' ' ALA . 0.2 OUTLIER -108.9 155.65 20.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 178.511 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -42.49 -36.43 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -99.18 -38.06 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.47 ' HB3' ' OG1' ' A' ' 98' ' ' THR . . . -62.75 -15.32 52.79 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.497 ' CD1' ' HA3' ' A' ' 97' ' ' GLY . 0.3 OUTLIER -95.33 177.09 5.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.002 0.43 . . . . 0.0 111.486 -179.585 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 105' ' ' LYS . 10.3 t80 -61.53 120.64 10.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.138 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 87.0 p -70.85 -57.6 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -41.54 -29.96 0.19 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.59 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' ' 108' ' ' ARG . 2.8 m -126.3 -53.25 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 111.573 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 71.98 11.1 6.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.216 -179.597 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.613 ' HB2' HG22 ' A' ' 106' ' ' THR . 0.1 OUTLIER -103.31 -33.73 9.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.0 110.863 179.915 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -116.85 164.16 15.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.172 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 1.1 p -59.76 -38.13 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.999 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 p -150.34 154.09 37.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 0.0 111.575 -178.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.471 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 13.9 p -49.69 -34.22 8.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.274 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 5.9 t -65.66 -45.28 83.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.401 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t -57.34 -44.9 84.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.433 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.0 t -58.9 -63.15 1.4 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.649 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -51.47 -26.15 7.72 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.941 0.4 . . . . 0.0 110.187 179.322 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.8 t -68.51 -57.22 6.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -48.23 -39.6 21.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.938 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 8.1 t -68.19 -53.91 21.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.543 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 47.0 m -75.38 -3.05 31.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.091 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -112.62 -23.89 9.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.654 0.264 . . . . 0.0 111.291 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.0 t -167.57 171.11 10.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.959 0.409 . . . . 0.0 111.163 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.45 134.18 12.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.831 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.978 -179.947 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 50.28 -134.02 28.82 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.765 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.6 p -134.19 40.27 3.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.909 0.385 . . . . 0.0 110.739 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.5 116.87 49.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.865 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 27.7 Cg_exo -62.04 138.89 75.82 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.455 2.104 . . . . 0.0 112.364 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -134.13 129.41 35.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.74 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 96' ' ' VAL . 17.8 t -87.45 134.02 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.199 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 46.9 t -73.7 121.64 21.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.109 0.481 . . . . 0.0 110.772 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.521 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.6 mm-40 -63.25 -25.82 68.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.715 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.98 -58.38 2.49 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.14 -33.6 19.37 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.07 16.91 45.55 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.616 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.2 mm -91.57 134.44 30.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 89' ' ' VAL . 2.9 t -99.23 137.6 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.348 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.435 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.57 -168.05 15.08 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.953 179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 74.8 p -104.32 140.71 37.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.644 0.259 . . . . 0.0 110.527 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.36 -37.47 3.37 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -78.82 7.71 6.64 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -179.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.87 -33.19 3.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.852 0.358 . . . . 0.0 111.344 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.474 ' CG ' ' HA ' ' A' ' 110' ' ' CYS . 2.4 m-30 -74.41 162.29 28.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.722 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 110' ' ' CYS . 8.0 t80 -55.88 89.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.433 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.1 m -41.33 -31.73 0.25 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.564 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.496 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 2.1 tppt? -46.04 -46.47 16.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 1.1 p -122.81 -37.11 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.066 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 10.9 mmtp 78.14 -36.94 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.684 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -62.04 -32.49 73.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.412 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.693 ' HB3' ' SG ' ' A' ' 114' ' ' CYS . 31.6 m-85 -114.39 129.84 56.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.411 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 103' ' ' PHE . 1.8 p -48.64 -63.03 1.2 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.994 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.3 p -106.8 165.85 11.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.313 0.578 . . . . 0.0 112.434 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 103' ' ' PHE . 10.8 p -70.95 -26.29 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.021 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.409 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 71.1 p -66.77 -55.02 16.83 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.2 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.693 ' SG ' ' HB3' ' A' ' 109' ' ' PHE . 30.5 p -59.25 -21.17 59.18 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.431 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 5.3 p -77.65 -50.97 11.39 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.526 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 7.9 ptp85 -64.98 -19.66 66.09 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 1.1 m -74.6 -54.18 7.96 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.521 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.3 t80 -57.22 -26.46 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 178.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 55.2 p -85.35 -32.91 22.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.027 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.2 t -104.15 -8.43 19.44 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 117' ' ' SER . 3.9 m-80 -88.93 0.76 56.34 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m 61.13 79.64 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.5 tptt 52.28 86.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 27.7 tptt . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.904 179.831 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 112.525 -0.23 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.58 101.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 111.049 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -144.24 -82.47 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.89 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.1 m -86.41 76.75 9.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.988 0.423 . . . . 0.0 110.085 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -104.84 116.51 60.72 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.242 177.705 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -92.13 115.61 0.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.491 2.127 . . . . 0.0 112.594 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.602 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -109.05 160.81 15.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.58 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.454 HG22 HG13 ' A' ' 96' ' ' VAL . 21.6 t -139.77 127.49 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.796 0.331 . . . . 0.0 111.408 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -80.07 113.62 18.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.482 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.85 -21.42 56.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.6 tpt -94.97 -58.46 2.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 22.6 m -80.44 -27.24 38.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.5 17.77 75.08 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.766 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.6 mm -89.14 132.42 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 CA-C-O 121.032 0.444 . . . . 0.0 110.476 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.602 HG13 ' O ' ' A' ' 88' ' ' ALA . 2.7 t -99.67 130.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.531 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.464 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.65 150.63 22.66 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.957 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 67.9 p -57.82 143.11 43.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 0.0 111.014 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.409 ' CG ' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -45.29 -47.58 13.03 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.667 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.62 -11.51 35.89 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.03 -20.69 13.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.957 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.464 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 2.1 m-85 -96.84 156.56 16.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.324 0.583 . . . . 0.0 112.026 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.483 ' CE1' ' HD3' ' A' ' 105' ' ' LYS . 2.7 t80 -43.72 96.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.991 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . 83.6 p -56.74 -26.17 56.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.155 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HD3' ' CE1' ' A' ' 103' ' ' PHE . 0.1 OUTLIER -47.79 -51.57 22.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.727 0.298 . . . . 0.0 111.274 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.24 -24.14 3.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 104' ' ' SER . 14.6 mmtm 61.14 54.19 3.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.362 0.601 . . . . 0.0 109.728 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 108' ' ' ARG . 45.0 mtp85 -124.68 -66.05 1.0 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.555 1.169 . . . . 0.0 108.63 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.458 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 15.1 m-85 -100.65 145.65 28.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 112.71 -2.041 . . . . 0.0 110.449 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -64.34 -10.03 21.7 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.7 p -151.65 154.18 35.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.574 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.9 p -61.55 -33.68 58.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.327 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -63.43 -41.77 98.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.106 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.458 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 63.9 m -62.51 -28.03 69.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -51.8 9.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.778 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 120' ' ' SER . 0.1 OUTLIER -68.16 -19.19 64.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.403 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 4.9 m -82.76 -47.09 12.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.95 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 2.0 t80 -66.26 -25.04 66.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.779 179.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.8 t -85.68 -54.56 4.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.476 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 116' ' ' ARG . 3.2 m -80.41 4.42 18.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.088 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 117' ' ' SER . 35.6 t30 -142.15 3.94 1.6 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.458 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.2 OUTLIER -154.12 173.09 16.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.15 0.5 . . . . 0.0 111.738 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -170.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.824 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.806 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.43 127.28 50.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.016 0.436 . . . . 0.0 111.204 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 160.37 19.93 0.03 OUTLIER Glycine 0 CA--C 1.524 0.62 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.862 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.48 ' O ' HG22 ' A' ' 98' ' ' THR . 0.3 OUTLIER -130.76 -6.79 4.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 117.355 0.577 . . . . 0.0 111.383 179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.53 116.97 4.03 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.53 -178.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.48 ' HB3' HG12 ' A' ' 96' ' ' VAL . 50.3 Cg_exo -56.41 145.91 76.54 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.946 2.431 . . . . 0.0 112.782 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.79 126.5 51.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.321 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.8 126.28 41.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 111.314 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 116.49 17.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.259 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.29 -28.39 66.72 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.441 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.6 tpt -90.67 -58.23 2.55 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.554 ' HB3' HD11 ' A' ' 95' ' ' ILE . 10.3 m -83.94 -41.71 17.05 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.37 9.0 45.51 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.787 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.721 HG22 ' H ' ' A' ' 96' ' ' VAL . 1.5 mm -56.17 179.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.0 t -149.41 113.99 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.364 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.19 144.77 12.32 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.49 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 85' ' ' SER . 4.6 p -62.75 138.71 58.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -31.43 -45.59 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -64.35 3.79 0.43 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 98' ' ' THR . . . -134.14 20.91 3.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.702 0.287 . . . . 0.0 110.914 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -132.06 155.28 48.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.022 0.439 . . . . 0.0 111.575 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.425 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.0 t80 -44.5 99.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.935 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.53 -27.18 15.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.927 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.425 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 6.8 tptp -47.8 -59.29 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 111.022 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.1 p -122.48 -33.96 3.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.94 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.18 -4.59 2.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.445 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 21.8 mtp180 -83.88 -24.97 30.6 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.854 0.359 . . . . 0.0 110.757 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -126.93 138.91 53.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.37 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.4 p -63.16 -12.95 31.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -156.25 159.14 38.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.81 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.31 -33.41 63.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 178.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 t -57.54 -41.76 81.6 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.327 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.87 -21.26 63.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.308 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.8 t -79.88 -51.67 8.84 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.135 0.493 . . . . 0.0 110.143 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -67.79 -17.47 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.4 t -82.38 -52.37 6.97 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.686 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.496 ' CE2' ' HG2' ' A' ' 123' ' ' LYS . 5.6 t80 -60.32 -22.88 63.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.704 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.28 -43.4 11.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.205 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 38.7 m -82.85 -54.63 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' O ' ' A' ' 122' ' ' SER . 11.4 m120 -64.65 -5.73 6.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.525 ' O ' ' O ' ' A' ' 121' ' ' ASN . 70.4 m 35.32 107.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.496 ' HG2' ' CE2' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -77.55 -43.84 30.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.92 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' ' CB ' ' A' ' 83' ' ' SER . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.484 -0.246 . . . . 0.0 112.484 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 82' ' ' GLY . 1.7 p 163.05 -88.51 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.627 0.251 . . . . 0.0 110.791 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.82 48.39 2.27 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.51 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.8 p -114.89 9.97 16.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.565 0.221 . . . . 0.0 111.208 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.6 mt-10 -92.13 116.8 67.12 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.882 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 4.6 Cg_exo -74.46 148.15 37.49 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.703 2.269 . . . . 0.0 112.215 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.708 ' HB3' ' CE2' ' A' ' 102' ' ' PHE . . . -143.02 136.22 28.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.227 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.618 HG12 ' HA2' ' A' ' 94' ' ' GLY . 17.0 t -90.9 133.8 31.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 20.3 t -64.9 124.82 23.01 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.457 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -69.52 3.83 2.16 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -118.41 -52.17 2.38 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.577 0.703 . . . . 0.0 109.862 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.472 ' CB ' HD11 ' A' ' 95' ' ' ILE . 5.9 m -96.9 -48.28 5.5 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.862 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.618 ' HA2' HG12 ' A' ' 89' ' ' VAL . . . 111.8 6.58 24.63 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -176.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.778 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.1 mm -52.18 -177.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.778 ' H ' HG22 ' A' ' 95' ' ' ILE . 2.5 t -138.53 136.11 43.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.265 0.555 . . . . 0.0 111.17 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.25 162.29 29.45 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.76 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.468 ' OG1' ' HB2' ' A' ' 101' ' ' ALA . 7.2 p -73.48 148.38 43.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.508 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -47.14 -31.05 3.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.467 -178.883 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.472 ' N ' ' HG3' ' A' ' 99' ' ' ARG . 26.6 mt-10 -85.95 -38.82 17.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.468 ' HB2' ' OG1' ' A' ' 98' ' ' THR . . . -59.94 -23.76 63.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.708 ' CE2' ' HB3' ' A' ' 88' ' ' ALA . 6.9 m-85 -72.72 161.18 31.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.075 0.464 . . . . 0.0 111.822 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.547 ' CE2' HG23 ' A' ' 112' ' ' VAL . 6.4 t80 -58.44 102.21 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.211 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' NZ ' ' A' ' 107' ' ' LYS . 77.3 p -38.99 -29.48 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.085 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 21.9 tttt -50.04 -60.7 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.014 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.0 p -128.21 -24.44 3.13 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 102' ' ' PHE . 0.0 OUTLIER 70.19 21.58 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.678 0.275 . . . . 0.0 111.06 -179.473 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -110.46 -9.44 14.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.56 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.436 ' CD1' ' CB ' ' A' ' 115' ' ' SER . 35.5 m-85 -128.93 151.39 49.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.745 0.307 . . . . 0.0 110.854 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 4.0 p -61.26 -27.16 68.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 p -160.48 157.6 27.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.968 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.547 HG23 ' CE2' ' A' ' 103' ' ' PHE . 10.9 p -53.18 -31.49 17.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.014 0.435 . . . . 0.0 110.332 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.433 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 25.0 p -68.03 -47.79 67.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.44 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.58 -43.4 84.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.927 0.394 . . . . 0.0 110.254 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.436 ' CB ' ' CD1' ' A' ' 109' ' ' PHE . 47.1 p -57.25 -61.12 2.69 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.594 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 113' ' ' SER . 10.9 ptm180 -54.39 -25.74 26.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.108 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.31 -61.92 1.62 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.277 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.536 ' HD1' ' O ' ' A' ' 118' ' ' TYR . 0.9 OUTLIER -46.26 -43.94 15.99 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.094 0.473 . . . . 0.0 111.61 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.3 t -69.51 -53.73 17.68 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.693 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.7 m -69.07 0.16 5.0 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -91.33 -10.57 40.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.644 0.259 . . . . 0.0 111.103 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 73.88 84.28 0.11 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.855 0.359 . . . . 0.0 111.011 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -82.39 -80.73 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.817 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 tttt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.9 -179.896 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -111.65 -2.95 15.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.588 0.232 . . . . 0.0 111.402 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -122.69 131.92 8.49 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.558 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.4 m 40.78 94.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.791 0.329 . . . . 0.0 111.821 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 6.3 mm-40 -98.93 116.82 65.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.671 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 17.2 Cg_exo -66.36 160.22 46.44 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.401 2.067 . . . . 0.0 112.423 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.793 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -136.47 141.45 43.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.216 179.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.449 ' HA ' HG22 ' A' ' 96' ' ' VAL . 21.4 t -110.46 126.38 67.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.848 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 50.5 t -86.57 85.52 7.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.369 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.453 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 6.7 mm-40 -46.21 -20.69 0.11 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -178.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.488 ' HB2' ' HB2' ' A' ' 118' ' ' TYR . 0.4 OUTLIER -82.95 -58.7 2.75 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.004 0.431 . . . . 0.0 111.325 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.439 ' HB2' HD12 ' A' ' 95' ' ' ILE . 34.0 m -88.99 -56.93 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.09 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 126.89 -10.37 7.06 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 93' ' ' CYS . 3.9 mt -52.2 155.37 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 88' ' ' ALA . 46.4 t -147.58 125.16 3.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.856 0.36 . . . . 0.0 111.67 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -145.04 -167.8 12.45 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.92 128.46 36.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.48 0.64 . . . . 0.0 111.072 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 101' ' ' ALA . 5.7 mtt180 -33.8 -66.12 0.17 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.311 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -47.31 -6.89 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' ARG . . . -94.96 -50.32 5.16 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.81 179.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -51.46 172.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.447 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.0 t80 -55.01 110.16 0.63 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.921 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.6 p -68.45 -24.84 64.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.4 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 4.5 mttt -55.58 -55.44 31.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.255 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.7 -37.43 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.107 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.29 10.77 7.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.343 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.401 ' O ' ' CD1' ' A' ' 109' ' ' PHE . 37.3 mtm180 -113.48 -3.62 13.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.452 ' CE1' ' HD1' ' A' ' 118' ' ' TYR . 40.6 m-85 -147.33 161.77 40.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.226 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 7.1 p -85.5 24.33 1.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.8 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER 174.15 -175.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.574 0.702 . . . . 0.0 112.409 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 113' ' ' SER . 7.1 p -91.24 -54.51 7.34 Favored 'Isoleucine or valine' 0 C--O 1.25 1.104 0 CA-C-N 114.7 -1.136 . . . . 0.0 109.953 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.56 ' N ' HG13 ' A' ' 112' ' ' VAL . 3.9 p -66.32 -27.41 67.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.493 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.2 t -63.47 -37.81 88.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.769 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 13.3 t -67.83 -67.19 0.48 Allowed 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -21.1 12.2 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.545 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 113' ' ' SER . 4.2 m -73.54 -58.33 3.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 92' ' ' MET . 8.4 t80 -48.22 -35.22 11.48 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.4 t -84.45 -62.65 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.421 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.4 m -58.43 -54.98 40.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.56 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -86.53 -52.82 5.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.08 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.1 p 56.77 53.5 8.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.975 0.417 . . . . 0.0 110.617 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.75 -168.04 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.702 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.3 mttt . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.939 179.845 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.623 0.249 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 97.3 Cg_endo -84.81 132.33 4.73 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.624 2.216 . . . . 0.0 112.775 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -119.23 102.17 8.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.887 HG13 HG22 ' A' ' 96' ' ' VAL . 11.0 t -79.08 138.28 20.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.788 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -84.2 120.48 26.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.539 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -69.19 -20.54 63.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.838 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.5 -58.26 2.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.767 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.3 m -91.44 -29.68 16.91 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.39 -19.49 53.63 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.574 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.7 mt -54.44 134.36 17.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.815 0.34 . . . . 0.0 111.449 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.887 HG22 HG13 ' A' ' 89' ' ' VAL . 12.8 t -114.93 141.71 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.48 -173.4 20.62 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.978 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 p -89.78 142.65 27.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.75 -42.56 5.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -1.84 16.66 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.41 -28.02 7.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.317 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 0.8 OUTLIER -87.56 160.41 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 111.451 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.93 110.43 0.23 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.347 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.2 m -62.58 -27.31 69.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.397 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 1.1 ttmt -50.76 -60.28 3.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.801 0.334 . . . . 0.0 111.166 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.408 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.6 p -116.96 -40.37 3.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.71 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.423 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 82.93 -21.6 0.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.653 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -68.22 -32.38 72.55 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 25.9 m-85 -119.49 142.97 47.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -66.26 -11.22 48.94 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -152.85 155.27 36.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.887 0.375 . . . . 0.0 111.662 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.434 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -63.22 -34.06 64.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.065 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 82.5 p -58.94 -44.31 91.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.926 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 54.9 m -58.69 -24.6 61.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.534 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.82 -50.75 10.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.797 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -69.36 -19.28 63.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.407 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 1.4 m -82.1 -51.51 7.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.082 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.0 -26.0 68.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.85 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.37 -46.11 9.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.307 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.02 0.7 54.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.277 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 117' ' ' SER . 55.0 t30 . . . . . 0 C--N 1.33 -0.273 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.8 mm-40 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.548 0.213 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 15.8 Cg_exo -68.38 136.81 37.99 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.58 2.186 . . . . 0.0 112.43 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.97 116.31 22.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.876 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 96' ' ' VAL . 19.6 t -81.49 136.53 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.534 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -80.07 119.86 23.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.271 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.35 -22.6 66.83 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 2.9 tpt -91.21 -58.26 2.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.06 -29.83 19.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 98.41 -22.04 42.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.266 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.5 mm -54.79 136.34 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.961 0.41 . . . . 0.0 111.085 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 89' ' ' VAL . 6.5 t -108.03 139.9 28.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.889 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.465 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.7 158.52 27.72 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.299 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.2 p -68.99 143.68 54.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.83 0.315 . . . . 0.0 110.399 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -44.84 -41.92 7.47 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.91 -4.37 27.87 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.92 -27.32 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.303 . . . . 0.0 111.122 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -88.28 158.95 18.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.26 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.82 118.57 1.66 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.205 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 26.7 t -65.52 -27.0 68.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.542 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.455 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 16.4 tptp -52.32 -49.07 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 7.4 p -128.12 -42.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.335 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 22.9 mmtm 84.79 -20.88 0.27 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.455 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -75.33 -25.0 57.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.866 0.365 . . . . 0.0 110.616 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.418 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 45.6 m-85 -120.75 133.34 55.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.175 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.5 p -63.02 -12.75 28.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -151.62 153.78 35.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.004 0.43 . . . . 0.0 111.884 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.0 p -60.95 -35.49 65.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.045 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.5 t -59.62 -40.77 88.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.773 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 8.5 m -60.8 -27.66 68.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.224 179.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 t -74.73 -53.82 8.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.878 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -70.55 -17.58 62.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.59 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.1 m -81.83 -49.24 10.6 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.6 -25.25 65.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.778 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -83.93 -50.85 7.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.246 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.0 t -61.15 -51.43 69.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.18 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.671 179.668 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.74 0.305 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.33 131.3 3.53 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.887 2.392 . . . . 0.0 112.759 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -116.78 106.65 13.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.906 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.718 HG13 HG22 ' A' ' 96' ' ' VAL . 4.7 t -82.06 126.31 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.416 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.33 122.45 22.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.414 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -66.3 -22.15 66.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.78 -58.23 2.55 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 m -86.13 -33.39 20.9 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.18 16.91 54.95 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.425 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.72 132.87 34.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.423 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.718 HG22 HG13 ' A' ' 89' ' ' VAL . 3.5 t -108.77 135.93 46.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.382 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.36 171.49 30.24 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.288 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 39.0 p -72.45 137.6 46.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.573 0.225 . . . . 0.0 110.581 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.403 ' HG2' ' HG2' ' A' ' 107' ' ' LYS . 20.0 mtp180 -43.27 -40.94 3.72 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.27 0.23 6.79 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -118.97 -19.15 8.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.646 0.26 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.457 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.5 m-85 -93.38 158.84 15.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.154 0.502 . . . . 0.0 111.745 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 105' ' ' LYS . 2.7 t80 -44.63 111.68 0.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.32 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 69.6 m -64.26 -31.16 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.426 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.453 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -49.63 -57.29 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.221 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.572 HG22 ' NE ' ' A' ' 108' ' ' ARG . 0.2 OUTLIER -113.79 -46.1 3.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 85.33 -26.09 0.11 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.424 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.572 ' NE ' HG22 ' A' ' 106' ' ' THR . 14.1 mtm180 -69.86 -32.99 71.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.875 0.369 . . . . 0.0 110.597 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.4 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 22.8 m-85 -118.25 138.48 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.437 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 29.5 p -63.12 -13.73 40.04 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.7 p -150.55 152.96 34.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.975 0.417 . . . . 0.0 111.739 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.408 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.79 -33.75 61.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.991 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 8.0 t -60.7 -37.97 83.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.803 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 58.1 m -62.87 -24.7 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.162 179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -50.24 10.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -70.53 -19.52 62.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.398 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 11.3 t -80.98 -51.17 8.82 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.802 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -63.69 -26.01 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.65 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.47 -43.36 11.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.438 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -87.56 -0.34 56.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.395 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.87 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.752 0.311 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.2 Cg_endo -86.53 131.15 3.38 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.885 2.39 . . . . 0.0 112.88 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.817 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -108.89 164.63 12.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.787 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 20.7 t -138.13 126.28 30.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.498 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -73.85 108.88 6.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.076 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.42 ' HG2' ' CZ ' ' A' ' 118' ' ' TYR . 1.9 tp10 -55.26 -19.18 7.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.304 -178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.2 tpt -100.29 -58.68 1.85 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -178.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.83 -30.89 40.52 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 94.09 -21.0 44.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.454 -0.879 . . . . 0.0 112.431 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 33.5 mm -52.49 133.71 14.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.528 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.817 HG13 ' O ' ' A' ' 88' ' ' ALA . 16.4 t -110.43 140.86 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.252 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.33 -167.79 14.74 Favored Glycine 0 C--O 1.227 -0.298 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.802 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 70.4 p -98.38 142.16 30.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.969 0.384 . . . . 0.0 110.339 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HG2' ' NZ ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.65 -42.53 7.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.08 -1.13 16.12 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.06 -31.29 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.862 0.363 . . . . 0.0 111.091 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -81.26 161.12 24.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.334 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.466 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 1.2 t80 -44.69 118.08 1.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.139 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.8 m -71.95 -29.27 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.588 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.466 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 19.5 tptp -57.84 -38.71 76.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.43 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 44.1 p -128.21 -48.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 11.6 mmtp 84.09 -31.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 55.9 mtm180 -62.09 -46.99 86.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.837 0.351 . . . . 0.0 110.28 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -105.17 143.28 33.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.474 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 30.7 p -66.72 -11.01 52.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -154.06 156.44 37.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.938 0.399 . . . . 0.0 111.689 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.8 p -64.93 -33.73 65.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.91 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 0.2 OUTLIER -58.03 -45.47 86.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.838 179.142 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 95.4 m -59.33 -24.48 63.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.334 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.6 t -76.1 -50.17 15.39 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.726 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -70.39 -21.54 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.491 179.257 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -49.27 12.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.886 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 91' ' ' GLU . 1.7 t80 -65.87 -25.88 67.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.873 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.0 p -88.01 -40.06 14.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.132 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 1.1 t -90.43 -4.09 57.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.845 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 47.4 t30 . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.684 0.278 . . . . 0.0 111.3 -179.763 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.254 0 CA-C-O 120.524 0.202 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_exo -65.06 126.45 16.49 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.551 2.167 . . . . 0.0 112.697 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -118.0 102.51 9.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.783 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.845 HG13 HG22 ' A' ' 96' ' ' VAL . 7.3 t -79.24 132.74 31.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.432 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 32.2 t -80.41 121.7 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.582 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -69.39 -20.2 63.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.775 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 7.8 tpt -89.52 -58.2 2.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 6.6 m -89.15 -31.7 17.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.09 17.96 51.82 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.523 -0.846 . . . . 0.0 112.473 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mm -91.77 134.05 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.384 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.845 HG22 HG13 ' A' ' 89' ' ' VAL . 3.2 t -109.92 137.51 41.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.182 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.54 -178.05 25.04 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.983 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.7 p -81.87 136.74 35.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.789 0.294 . . . . 0.0 110.249 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mtp180 -43.2 -38.42 2.5 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.64 3.83 3.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.17 -21.05 6.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.688 0.28 . . . . 0.0 111.435 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.8 m-85 -91.07 160.71 15.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.09 0.471 . . . . 0.0 111.504 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.493 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.57 108.23 0.11 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.096 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 t -57.54 -42.54 83.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.842 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.493 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 2.8 mmpp? -46.5 -60.29 2.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.45 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -102.52 -52.41 3.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.048 -179.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.454 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 86.57 -27.31 0.08 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.507 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.94 -32.57 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.9 0.381 . . . . 0.0 110.72 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -117.4 144.41 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.644 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.3 p -66.08 -11.36 48.15 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.9 p -154.87 157.38 37.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.902 0.382 . . . . 0.0 111.644 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.4 p -65.29 -34.77 72.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.978 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.408 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 62.3 p -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.736 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.71 -22.04 63.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.389 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.88 -48.39 11.59 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 2.4 ptp180 -70.72 -20.59 62.64 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 5.0 t -78.95 -50.7 10.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.95 -24.17 67.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.529 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.5 p -88.19 -34.39 17.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.805 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 66.4 m -93.81 -6.17 46.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.013 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 58.6 m-80 . . . . . 0 C--N 1.332 -0.182 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 CA--C 1.528 0.12 0 CA-C-O 120.76 0.314 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 89.1 Cg_endo -85.73 131.58 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.791 2.327 . . . . 0.0 112.792 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.725 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.81 99.52 7.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.306 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 96' ' ' VAL . 38.5 t -79.08 126.27 38.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.434 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.16 115.22 10.05 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 109' ' ' PHE . 2.4 tt0 -71.59 -21.24 61.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.704 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -13.26 23.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.441 ' HB2' HD12 ' A' ' 95' ' ' ILE . 55.8 m -132.05 -43.69 0.96 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 118.131 0.423 . . . . 0.0 111.666 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 119.35 -32.48 5.05 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.441 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.5 mp -52.54 132.33 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.84 0.352 . . . . 0.0 111.855 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.689 HG22 HG13 ' A' ' 89' ' ' VAL . 10.9 t -115.55 141.77 31.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.704 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -176.73 23.71 Favored Glycine 0 C--O 1.228 -0.273 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.116 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.9 p -86.99 142.19 28.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.791 0.296 . . . . 0.0 110.292 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.53 -41.56 2.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.167 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.95 -1.58 10.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.04 -17.62 8.95 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 2.2 m-85 -97.2 159.05 15.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.022 0.439 . . . . 0.0 111.669 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.482 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 4.7 t80 -44.93 113.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.9 t -59.91 -39.53 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.776 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -46.68 -60.31 2.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.81 0.338 . . . . 0.0 111.568 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.435 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 22.5 p -106.61 -52.16 2.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.725 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 84.77 -23.07 0.18 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.461 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.0 -27.93 60.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.686 0.279 . . . . 0.0 110.922 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 32.1 m-85 -119.52 137.41 53.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.465 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.414 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 26.9 p -57.68 -15.01 6.49 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.0 p -152.24 154.56 36.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.997 0.427 . . . . 0.0 112.001 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.454 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -63.26 -35.82 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.023 178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.6 p -57.85 -38.97 76.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.614 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.9 m -60.93 -24.41 66.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.347 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 -51.14 10.01 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 ptp85 -70.36 -17.58 63.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.321 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.3 m -83.94 -50.06 8.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.14 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.85 -24.04 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.864 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.1 t -88.11 -49.34 7.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.931 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 2.0 t -77.9 -58.31 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.995 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 C--N 1.33 -0.245 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.789 0.328 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.27 135.21 22.22 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.019 2.479 . . . . 0.0 112.613 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.57 123.02 39.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.638 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.533 HG13 HG22 ' A' ' 96' ' ' VAL . 13.7 t -80.31 144.19 11.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.67 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 48.7 t -90.06 119.79 30.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.476 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -64.23 -23.52 67.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -91.61 -58.17 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.0 -29.33 19.57 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.77 -23.18 37.11 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.978 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.6 mm -53.9 137.12 14.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.933 0.397 . . . . 0.0 111.059 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.533 HG22 HG13 ' A' ' 89' ' ' VAL . 6.2 t -108.53 138.44 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.704 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.72 150.86 22.92 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.086 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.0 p -57.61 138.62 55.11 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -46.52 -36.52 6.82 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -70.26 0.67 5.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.55 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.58 -19.41 7.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.318 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -92.08 158.07 16.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 105' ' ' LYS . 2.2 t80 -45.2 115.35 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.113 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 33.4 p -62.8 -28.9 70.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.555 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HB3' ' CD2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -54.12 -60.5 3.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 0.0 111.187 -179.602 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.442 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.6 OUTLIER -107.34 -46.25 3.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.078 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.97 -26.68 0.1 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.515 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 7.5 mtm-85 -71.97 -23.05 61.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 91' ' ' GLU . 24.7 m-85 -121.58 140.72 51.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.6 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.2 p -66.94 -12.14 58.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.46 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.5 p -152.91 154.85 35.88 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.441 . . . . 0.0 112.059 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.448 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -62.91 -35.57 71.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.911 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.2 p -58.21 -40.63 82.13 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.792 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.56 -24.53 65.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.406 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -79.91 -49.36 12.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -20.66 62.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.408 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 5.6 m -80.25 -52.02 8.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.782 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.4 t80 -63.7 -25.89 68.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.715 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -88.69 -42.86 11.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.429 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.6 t -88.71 -2.02 58.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.247 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.838 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 CA--C 1.53 0.186 0 CA-C-O 120.488 0.185 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -61.52 133.03 43.53 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.51 2.14 . . . . 0.0 112.442 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -121.84 114.24 20.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.545 HG13 HG22 ' A' ' 96' ' ' VAL . 19.7 t -78.99 135.27 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.432 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 38.6 t -80.97 120.18 24.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.744 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.456 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -67.43 -21.39 65.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.971 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -58.32 2.53 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.3 m -90.85 -27.72 18.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.46 -19.91 52.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.485 -0.865 . . . . 0.0 112.146 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.3 mm -57.76 142.16 13.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.987 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.545 HG22 HG13 ' A' ' 89' ' ' VAL . 4.3 t -115.67 142.91 26.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.952 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.34 161.03 28.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.112 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 71.1 p -69.26 140.11 54.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.447 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 12.5 ptm180 -41.58 -41.25 2.11 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -71.31 0.66 7.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.94 -21.15 6.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.577 0.227 . . . . 0.0 111.594 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -92.64 161.25 14.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.933 0.397 . . . . 0.0 111.33 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.463 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 3.3 t80 -44.65 100.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.082 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.9 m -55.98 -25.01 42.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.731 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.463 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 1.1 tptp -54.4 -59.83 4.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 111.044 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.437 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.0 OUTLIER -117.19 -40.64 3.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.84 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 84.32 -17.52 0.46 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.663 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -61.68 -46.09 91.23 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.781 0.324 . . . . 0.0 110.588 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 9.0 m-85 -108.44 160.26 16.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.55 -5.78 49.09 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -161.6 164.33 29.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.098 0.475 . . . . 0.0 112.062 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 113' ' ' SER . 9.2 p -66.6 -44.58 89.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.299 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 112' ' ' VAL . 55.1 p -57.94 -36.11 72.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.853 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -67.23 -18.96 65.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.498 178.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 7.0 p -85.88 -46.73 10.32 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.623 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -74.78 -20.74 59.68 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.527 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 39.6 m -81.32 -53.63 6.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.52 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.456 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 15.7 t80 -67.15 -20.06 65.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.149 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -88.23 -49.86 6.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.203 0.525 . . . . 0.0 110.894 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 t -80.22 6.3 12.21 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.761 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.527 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.2 m-80 . . . . . 0 C--N 1.332 -0.182 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.825 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.707 0.289 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.9 Cg_endo -82.25 128.62 5.66 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.76 2.307 . . . . 0.0 113.277 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.822 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -106.5 169.85 8.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.814 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -139.29 126.32 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.84 0.352 . . . . 0.0 111.908 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 35.5 t -78.51 114.63 17.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.399 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -63.68 -18.63 64.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.244 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.5 tpt -94.38 -58.37 2.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.7 m -88.18 -25.37 22.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.13 22.13 61.54 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.385 -0.912 . . . . 0.0 112.24 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.9 mm -89.69 128.45 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.79 0.328 . . . . 0.0 110.479 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.822 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.1 t -103.65 134.56 44.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.15 -169.1 15.89 Favored Glycine 0 C--O 1.228 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.122 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.7 p -95.3 137.25 34.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.436 ' HG2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -43.58 -40.46 4.04 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.8 3.39 8.15 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.02 -28.61 4.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 111.436 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 0.4 OUTLIER -79.09 161.53 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 111.82 -179.407 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 2.3 t80 -44.67 106.4 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.237 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 47.5 m -62.94 -25.43 68.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.536 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -51.49 -60.39 3.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.778 0.323 . . . . 0.0 111.139 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.441 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.2 p -113.5 -36.76 4.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.441 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.57 -34.25 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.494 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.59 -51.06 68.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.819 0.342 . . . . 0.0 110.685 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -101.93 140.71 35.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.652 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 31.3 p -64.18 -14.45 55.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 112.31 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.1 p -151.67 154.22 35.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.842 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.429 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -63.16 -32.77 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.746 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' ARG . 4.2 t -57.74 -44.69 86.21 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.741 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 65.2 m -59.65 -27.67 66.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.171 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 t -72.12 -55.29 7.56 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.978 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -69.28 -18.1 63.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.907 0.384 . . . . 0.0 110.122 178.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 1.8 m -79.55 -54.02 6.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -61.17 -24.77 66.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.079 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.8 t -83.23 -52.93 6.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.512 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -50.9 8.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 37.8 t30 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 3.5 mm-40 . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.466 0.174 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 6.2 Cg_exo -77.86 131.54 11.22 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.359 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -120.35 98.93 6.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.69 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.801 HG13 HG22 ' A' ' 96' ' ' VAL . 11.6 t -79.74 133.76 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.249 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -78.08 118.66 20.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.646 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.5 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 7.1 mm-40 -65.79 -20.51 66.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.852 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -58.23 2.47 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.479 ' HB2' HD13 ' A' ' 95' ' ' ILE . 5.7 m -88.58 -31.89 18.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.05 19.28 43.42 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.865 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.479 HD13 ' HB2' ' A' ' 93' ' ' CYS . 3.2 mp -89.96 128.39 41.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.116 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.801 HG22 HG13 ' A' ' 89' ' ' VAL . 4.8 t -103.71 137.3 32.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.253 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.51 -174.96 22.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.766 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 p -90.49 143.17 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.952 0.376 . . . . 0.0 110.333 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 6.7 ptm180 -43.96 -42.23 5.8 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -71.67 0.01 9.79 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.91 -28.27 7.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 111.321 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.405 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 1.5 m-85 -87.96 160.08 18.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.2 t80 -44.98 105.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.4 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.4 p -57.43 -26.4 61.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.435 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -53.62 -60.04 3.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.163 -179.795 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.431 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.3 p -115.1 -43.55 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 83.57 -21.32 0.28 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.498 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -67.69 -34.07 76.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.74 0.305 . . . . 0.0 110.834 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.486 ' CE2' ' CD2' ' A' ' 118' ' ' TYR . 19.2 m-85 -118.42 148.22 42.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.502 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.405 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 14.9 p -66.83 -7.6 22.72 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.4 p -163.31 166.16 23.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.928 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 113' ' ' SER . 10.6 p -66.66 -46.19 86.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.453 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.496 ' N ' HG13 ' A' ' 112' ' ' VAL . 11.5 p -56.99 -39.69 75.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.14 0.495 . . . . 0.0 109.815 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 1.6 t -63.71 -18.91 64.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.478 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.1 t -85.56 -47.17 10.13 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -73.24 -19.73 61.01 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 8.4 t -82.19 -53.38 6.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.476 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.5 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 14.4 t80 -65.19 -20.45 66.45 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.141 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.4 t -87.99 -50.37 6.46 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.488 . . . . 0.0 110.632 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.3 m -81.48 3.61 24.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.071 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 117' ' ' SER . 0.8 OUTLIER . . . . . 0 N--CA 1.462 0.137 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.93 136.9 3.74 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.979 2.452 . . . . 0.0 112.427 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.73 108.25 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.731 HG13 HG22 ' A' ' 96' ' ' VAL . 9.8 t -81.62 128.08 39.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -75.43 120.43 20.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.535 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.454 ' HG2' ' CE1' ' A' ' 118' ' ' TYR . 1.5 tt0 -68.28 -17.77 64.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.719 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 9.6 tpt -92.62 -58.14 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.9 m -88.18 -31.99 18.83 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 -178.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.73 19.01 49.87 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.254 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -93.82 132.98 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 120.951 0.405 . . . . 0.0 110.063 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.731 HG22 HG13 ' A' ' 89' ' ' VAL . 2.9 t -105.04 133.47 49.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.387 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.57 151.59 23.59 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.833 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.6 p -59.14 140.31 56.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.019 0.41 . . . . 0.0 110.604 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.402 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 32.2 ptt85 -44.56 -33.9 1.93 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.24 -0.436 . . . . 0.0 112.007 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -68.13 -2.9 8.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.07 -1.13 7.77 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -109.55 158.06 18.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.178 0.513 . . . . 0.0 111.73 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.472 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 3.9 t80 -44.43 100.59 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.178 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.4 OUTLIER -49.87 -28.39 6.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.884 -179.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -50.44 -54.64 20.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.848 0.356 . . . . 0.0 111.216 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 2.1 p -128.01 -38.01 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.147 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 8.3 mmtp 81.27 -9.52 1.29 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.535 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -68.85 -34.29 75.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.601 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -118.35 143.74 46.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.1 p -63.7 -13.09 40.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -155.8 158.27 37.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.988 0.423 . . . . 0.0 111.907 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.4 p -65.73 -36.06 76.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.837 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 60.7 p -58.15 -39.2 78.2 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.568 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.67 -21.58 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.367 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.6 p -82.34 -48.41 11.19 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.673 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.401 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 27.5 ptt180 -71.95 -19.68 61.86 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.422 ' O ' ' N ' ' A' ' 121' ' ' ASN . 4.0 m -79.06 -51.88 8.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.454 ' CE1' ' HG2' ' A' ' 91' ' ' GLU . 1.9 t80 -63.56 -23.58 67.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.554 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 16.6 p -88.37 -35.74 16.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.739 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -92.59 -6.16 50.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.981 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 117' ' ' SER . 71.3 m-80 . . . . . 0 C--N 1.33 -0.252 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.812 0.339 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.408 ' HB2' ' CG1' ' A' ' 96' ' ' VAL . 92.2 Cg_endo -85.24 149.47 10.48 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.865 2.377 . . . . 0.0 112.546 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.455 ' C ' HG13 ' A' ' 96' ' ' VAL . . . -124.71 120.9 33.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.955 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.513 HG22 ' CG2' ' A' ' 96' ' ' VAL . 22.0 t -79.11 137.74 21.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.624 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 39.0 t -81.16 114.9 20.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.96 -22.1 62.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -95.9 -58.31 2.13 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.595 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.4 m -89.29 -28.98 19.51 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.12 -24.32 32.32 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.474 -179.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 93' ' ' CYS . 4.5 mp -52.71 138.1 11.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.914 0.388 . . . . 0.0 111.01 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.513 ' CG2' HG22 ' A' ' 89' ' ' VAL . 8.7 t -113.33 141.3 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.666 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.404 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.73 156.12 26.52 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.116 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.6 p -65.8 142.71 57.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.516 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -44.41 -34.96 2.2 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.442 ' N ' ' HG2' ' A' ' 99' ' ' ARG . 2.7 tp10 -74.17 -0.68 17.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.24 -18.9 7.25 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.404 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.5 m-85 -91.97 161.38 14.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.49 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.7 97.28 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.203 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.421 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 9.0 t -47.74 -28.88 2.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.064 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 0.8 OUTLIER -54.43 -60.42 3.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 p -119.64 -39.25 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 81.64 -14.15 0.82 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.719 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -64.19 -39.34 93.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.758 0.313 . . . . 0.0 110.549 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 115' ' ' SER . 11.5 m-85 -112.07 153.51 26.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.386 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.5 p -68.39 -7.69 33.72 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -165.53 168.41 16.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.051 0.453 . . . . 0.0 111.94 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.466 HG13 ' N ' ' A' ' 113' ' ' SER . 10.2 p -68.12 -43.27 85.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.237 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.466 ' N ' HG13 ' A' ' 112' ' ' VAL . 16.6 t -57.66 -40.61 79.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.8 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.34 -19.06 65.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.563 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.435 ' HA ' ' CD1' ' A' ' 109' ' ' PHE . 4.9 p -84.29 -45.35 12.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.53 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -74.21 -19.84 60.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.848 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.8 t -80.81 -53.88 6.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.584 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.404 ' HD1' ' CZ ' ' A' ' 109' ' ' PHE . 10.1 t80 -66.72 -22.39 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.999 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 t -88.31 -48.78 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.917 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.6 m -81.12 2.88 25.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.146 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.956 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.878 0.371 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 85.1 Cg_endo -84.94 128.42 3.75 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.857 2.371 . . . . 0.0 112.79 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.787 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -110.02 167.3 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.571 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.1 t -137.95 126.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.591 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.73 110.53 8.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.495 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 6.5 mp0 -58.38 -21.13 49.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.2 tpt -96.9 -58.52 2.01 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -82.96 -27.85 30.2 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.6 20.89 60.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.095 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -88.72 129.07 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.0 t -104.93 136.35 38.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 111.328 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -169.68 16.73 Favored Glycine 0 C--O 1.227 -0.289 0 N-CA-C 111.736 -0.546 . . . . 0.0 111.736 179.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.6 p -91.43 136.65 32.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.083 0.441 . . . . 0.0 110.137 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.46 ' HA ' ' CE ' ' A' ' 107' ' ' LYS . 20.7 mtp85 -42.9 -38.43 2.19 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.66 9.19 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.76 -34.66 4.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.999 0.428 . . . . 0.0 110.856 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -74.09 161.4 30.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 112.075 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 107' ' ' LYS . 4.6 t80 -44.34 152.16 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.886 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.1 m -96.16 -46.2 6.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.315 . . . . 0.0 111.559 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -47.8 -49.52 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -179.299 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.404 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 74.1 p -105.29 -49.0 3.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.33 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 103' ' ' PHE . 0.1 OUTLIER 82.95 -46.73 0.14 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.157 -179.632 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -60.88 -45.28 95.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.984 0.421 . . . . 0.0 110.487 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -96.88 145.38 25.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -68.73 -9.65 51.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -155.96 158.41 37.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.956 0.408 . . . . 0.0 111.757 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.452 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.0 p -63.96 -36.48 76.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.896 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.4 t -57.27 -44.05 83.63 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.731 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.7 m -60.0 -26.13 65.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.017 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 p -73.46 -52.21 14.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -69.55 -20.81 63.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.245 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.85 -53.1 7.44 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.996 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.495 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.8 t80 -63.74 -25.15 68.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.987 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.5 t -81.26 -55.48 4.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.6 m -79.44 -52.42 8.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.47 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 t30 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.737 -179.216 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.428 0.156 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.27 129.69 29.35 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.46 2.107 . . . . 0.0 112.661 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.93 109.7 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.615 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.711 HG13 HG22 ' A' ' 96' ' ' VAL . 11.3 t -82.29 131.71 33.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.834 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 45.1 t -79.43 119.81 22.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.44 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.477 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.2 mt-10 -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.1 tpt -88.52 -58.26 2.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 11.7 m -86.96 -35.6 18.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.679 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.99 -26.45 23.09 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.102 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -52.61 132.6 14.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 111.229 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.711 HG22 HG13 ' A' ' 89' ' ' VAL . 11.7 t -106.67 139.05 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.242 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.452 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.24 151.56 23.59 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 72.2 p -61.34 140.0 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.571 0.224 . . . . 0.0 110.895 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -39.85 -45.46 1.81 Allowed 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.04 -1.15 3.8 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.42 -10.66 9.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.63 0.252 . . . . 0.0 111.371 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.452 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.6 m-85 -105.45 159.09 16.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.208 0.527 . . . . 0.0 111.41 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.459 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 5.1 t80 -44.63 104.43 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.185 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.2 m -54.43 -35.29 62.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.875 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.459 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 0.3 OUTLIER -47.92 -60.36 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.728 0.299 . . . . 0.0 111.434 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.518 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 33.0 p -111.0 -46.39 3.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.717 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 106' ' ' THR . 6.4 mmtp 80.33 -15.67 0.73 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.841 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -74.56 -27.59 60.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.908 0.385 . . . . 0.0 110.394 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -123.54 140.0 53.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.516 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 25.1 p -60.16 -13.79 14.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.2 p -151.74 154.41 36.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.918 0.39 . . . . 0.0 111.859 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.56 -36.27 74.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 8.8 t -58.67 -40.08 82.51 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.733 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 118' ' ' TYR . 9.9 m -61.77 -23.76 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.303 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.3 p -79.33 -52.94 7.44 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.763 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 113' ' ' SER . 16.4 ptt-85 -70.05 -17.66 63.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.281 178.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.423 ' O ' ' ND2' ' A' ' 121' ' ' ASN . 4.6 m -82.79 -47.95 11.34 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.819 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.5 t80 -69.89 -21.59 63.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.934 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 p -88.18 -60.49 1.95 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.6 m -57.83 -44.03 86.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.035 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.423 ' ND2' ' O ' ' A' ' 117' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.608 0.242 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.579 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 34.5 Cg_exo -60.76 124.12 14.36 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.556 2.171 . . . . 0.0 112.21 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.41 ' O ' ' CE2' ' A' ' 102' ' ' PHE . . . -110.32 100.97 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 95' ' ' ILE . 16.7 t -79.11 140.19 17.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.914 0.388 . . . . 0.0 111.479 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.15 121.54 19.47 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -76.14 11.45 1.49 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.361 -0.836 . . . . 0.0 113.073 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.7 tpt -116.52 -55.23 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.454 ' HB2' ' CD1' ' A' ' 95' ' ' ILE . 6.4 m -96.06 -47.7 5.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.429 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 114.35 6.33 20.15 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.762 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.0 mm -52.35 -177.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.762 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.2 t -142.67 142.41 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-O 121.306 0.574 . . . . 0.0 111.571 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.99 -167.91 15.14 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.115 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.47 ' OG1' ' HB3' ' A' ' 101' ' ' ALA . 0.2 OUTLIER -108.9 155.65 20.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 178.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -42.49 -36.43 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -99.18 -38.06 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.47 ' HB3' ' OG1' ' A' ' 98' ' ' THR . . . -62.75 -15.32 52.79 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.497 ' CD1' ' HA3' ' A' ' 97' ' ' GLY . 0.3 OUTLIER -95.33 177.09 5.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.002 0.43 . . . . 0.0 111.486 -179.585 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 105' ' ' LYS . 10.3 t80 -61.53 120.64 10.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.138 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 87.0 p -70.85 -57.6 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -41.54 -29.96 0.19 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' ' 108' ' ' ARG . 2.8 m -126.3 -53.25 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 111.573 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 71.98 11.1 6.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.216 -179.597 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.613 ' HB2' HG22 ' A' ' 106' ' ' THR . 0.1 OUTLIER -103.31 -33.73 9.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.0 110.863 179.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -116.85 164.16 15.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.172 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 1.1 p -59.76 -38.13 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.999 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 p -150.34 154.09 37.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 0.0 111.575 -178.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.471 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 13.9 p -49.69 -34.22 8.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.274 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 5.9 t -65.66 -45.28 83.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.401 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t -57.34 -44.9 84.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.433 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.0 t -58.9 -63.15 1.4 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.649 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -51.47 -26.15 7.72 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.941 0.4 . . . . 0.0 110.187 179.322 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.8 t -68.51 -57.22 6.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -48.23 -39.6 21.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.938 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 8.1 t -68.19 -53.91 21.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.543 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 47.0 m -75.38 -3.05 31.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.091 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.3 t30 . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.654 0.264 . . . . 0.0 111.291 -179.839 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.533 0.206 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 27.7 Cg_exo -62.04 138.89 75.82 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.455 2.104 . . . . 0.0 112.364 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -134.13 129.41 35.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.74 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 96' ' ' VAL . 17.8 t -87.45 134.02 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.199 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 46.9 t -73.7 121.64 21.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.109 0.481 . . . . 0.0 110.772 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.521 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.6 mm-40 -63.25 -25.82 68.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.715 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.98 -58.38 2.49 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.14 -33.6 19.37 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.07 16.91 45.55 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.616 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.2 mm -91.57 134.44 30.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 89' ' ' VAL . 2.9 t -99.23 137.6 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.348 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.435 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.57 -168.05 15.08 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.953 179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 74.8 p -104.32 140.71 37.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.644 0.259 . . . . 0.0 110.527 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.36 -37.47 3.37 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -78.82 7.71 6.64 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -179.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.87 -33.19 3.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.852 0.358 . . . . 0.0 111.344 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.474 ' CG ' ' HA ' ' A' ' 110' ' ' CYS . 2.4 m-30 -74.41 162.29 28.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.722 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 110' ' ' CYS . 8.0 t80 -55.88 89.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.433 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.1 m -41.33 -31.73 0.25 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.564 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.496 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 2.1 tppt? -46.04 -46.47 16.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 1.1 p -122.81 -37.11 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.066 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 10.9 mmtp 78.14 -36.94 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.684 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -62.04 -32.49 73.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.412 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.693 ' HB3' ' SG ' ' A' ' 114' ' ' CYS . 31.6 m-85 -114.39 129.84 56.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.411 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 103' ' ' PHE . 1.8 p -48.64 -63.03 1.2 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.994 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.3 p -106.8 165.85 11.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.313 0.578 . . . . 0.0 112.434 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 103' ' ' PHE . 10.8 p -70.95 -26.29 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.021 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.409 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 71.1 p -66.77 -55.02 16.83 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.2 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.693 ' SG ' ' HB3' ' A' ' 109' ' ' PHE . 30.5 p -59.25 -21.17 59.18 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.431 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 5.3 p -77.65 -50.97 11.39 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.526 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 7.9 ptp85 -64.98 -19.66 66.09 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 1.1 m -74.6 -54.18 7.96 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.521 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.3 t80 -57.22 -26.46 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 178.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 55.2 p -85.35 -32.91 22.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.027 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.2 t -104.15 -8.43 19.44 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 117' ' ' SER . 3.9 m-80 . . . . . 0 C--N 1.33 -0.259 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.113 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -92.13 115.61 0.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.491 2.127 . . . . 0.0 112.594 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.602 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -109.05 160.81 15.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.58 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.454 HG22 HG13 ' A' ' 96' ' ' VAL . 21.6 t -139.77 127.49 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.796 0.331 . . . . 0.0 111.408 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -80.07 113.62 18.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.482 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.85 -21.42 56.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.6 tpt -94.97 -58.46 2.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 22.6 m -80.44 -27.24 38.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.5 17.77 75.08 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.766 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.6 mm -89.14 132.42 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 CA-C-O 121.032 0.444 . . . . 0.0 110.476 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.602 HG13 ' O ' ' A' ' 88' ' ' ALA . 2.7 t -99.67 130.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.531 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . 0.464 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.65 150.63 22.66 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.957 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 67.9 p -57.82 143.11 43.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 0.0 111.014 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.409 ' CG ' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -45.29 -47.58 13.03 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.667 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.62 -11.51 35.89 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.03 -20.69 13.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.957 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.464 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 2.1 m-85 -96.84 156.56 16.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.324 0.583 . . . . 0.0 112.026 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.483 ' CE1' ' HD3' ' A' ' 105' ' ' LYS . 2.7 t80 -43.72 96.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.991 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . 83.6 p -56.74 -26.17 56.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.155 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HD3' ' CE1' ' A' ' 103' ' ' PHE . 0.1 OUTLIER -47.79 -51.57 22.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.727 0.298 . . . . 0.0 111.274 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.24 -24.14 3.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 104' ' ' SER . 14.6 mmtm 61.14 54.19 3.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.362 0.601 . . . . 0.0 109.728 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 108' ' ' ARG . 45.0 mtp85 -124.68 -66.05 1.0 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.555 1.169 . . . . 0.0 108.63 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.458 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 15.1 m-85 -100.65 145.65 28.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 112.71 -2.041 . . . . 0.0 110.449 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -64.34 -10.03 21.7 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.7 p -151.65 154.18 35.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.574 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.9 p -61.55 -33.68 58.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.327 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -63.43 -41.77 98.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.106 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.458 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 63.9 m -62.51 -28.03 69.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -51.8 9.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.778 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 120' ' ' SER . 0.1 OUTLIER -68.16 -19.19 64.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.403 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 4.9 m -82.76 -47.09 12.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.95 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.26 -25.04 66.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.779 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.8 t -85.68 -54.56 4.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.476 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 116' ' ' ARG . 3.2 m -80.41 4.42 18.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.088 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 117' ' ' SER . 35.6 t30 . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.53 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.48 ' HB3' HG12 ' A' ' 96' ' ' VAL . 50.3 Cg_exo -56.41 145.91 76.54 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.946 2.431 . . . . 0.0 112.782 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.79 126.5 51.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.321 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.8 126.28 41.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 111.314 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 116.49 17.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.259 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.29 -28.39 66.72 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.441 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.6 tpt -90.67 -58.23 2.55 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.554 ' HB3' HD11 ' A' ' 95' ' ' ILE . 10.3 m -83.94 -41.71 17.05 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.37 9.0 45.51 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.787 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.721 HG22 ' H ' ' A' ' 96' ' ' VAL . 1.5 mm -56.17 179.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.0 t -149.41 113.99 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.364 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.19 144.77 12.32 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.49 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 101' ' ' ALA . 4.6 p -62.75 138.71 58.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -31.43 -45.59 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -64.35 3.79 0.43 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 98' ' ' THR . . . -134.14 20.91 3.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.702 0.287 . . . . 0.0 110.914 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -132.06 155.28 48.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.022 0.439 . . . . 0.0 111.575 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.425 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.0 t80 -44.5 99.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.935 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.53 -27.18 15.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.927 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.425 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 6.8 tptp -47.8 -59.29 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 111.022 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.1 p -122.48 -33.96 3.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.94 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.18 -4.59 2.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.445 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 21.8 mtp180 -83.88 -24.97 30.6 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.854 0.359 . . . . 0.0 110.757 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -126.93 138.91 53.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.37 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.4 p -63.16 -12.95 31.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -156.25 159.14 38.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.81 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.31 -33.41 63.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 178.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 t -57.54 -41.76 81.6 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.327 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.87 -21.26 63.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.308 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.8 t -79.88 -51.67 8.84 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.135 0.493 . . . . 0.0 110.143 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -67.79 -17.47 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.4 t -82.38 -52.37 6.97 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.686 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.429 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 5.6 t80 -60.32 -22.88 63.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.704 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.28 -43.4 11.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.205 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 38.7 m -82.85 -54.63 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 . . . . . 0 C--N 1.331 -0.235 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.414 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.6 mt-10 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.476 0.179 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 4.6 Cg_exo -74.46 148.15 37.49 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.703 2.269 . . . . 0.0 112.215 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.708 ' HB3' ' CE2' ' A' ' 102' ' ' PHE . . . -143.02 136.22 28.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.227 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.618 HG12 ' HA2' ' A' ' 94' ' ' GLY . 17.0 t -90.9 133.8 31.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 20.3 t -64.9 124.82 23.01 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.457 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -69.52 3.83 2.16 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -118.41 -52.17 2.38 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.577 0.703 . . . . 0.0 109.862 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.472 ' CB ' HD11 ' A' ' 95' ' ' ILE . 5.9 m -96.9 -48.28 5.5 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.862 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.618 ' HA2' HG12 ' A' ' 89' ' ' VAL . . . 111.8 6.58 24.63 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -176.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.778 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.1 mm -52.18 -177.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.778 ' H ' HG22 ' A' ' 95' ' ' ILE . 2.5 t -138.53 136.11 43.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.265 0.555 . . . . 0.0 111.17 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.25 162.29 29.45 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.76 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.468 ' OG1' ' HB2' ' A' ' 101' ' ' ALA . 7.2 p -73.48 148.38 43.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.508 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -47.14 -31.05 3.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.467 -178.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.472 ' N ' ' HG3' ' A' ' 99' ' ' ARG . 26.6 mt-10 -85.95 -38.82 17.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.468 ' HB2' ' OG1' ' A' ' 98' ' ' THR . . . -59.94 -23.76 63.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.708 ' CE2' ' HB3' ' A' ' 88' ' ' ALA . 6.9 m-85 -72.72 161.18 31.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.075 0.464 . . . . 0.0 111.822 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.547 ' CE2' HG23 ' A' ' 112' ' ' VAL . 6.4 t80 -58.44 102.21 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.211 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' NZ ' ' A' ' 107' ' ' LYS . 77.3 p -38.99 -29.48 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.085 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 21.9 tttt -50.04 -60.7 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.0 p -128.21 -24.44 3.13 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 102' ' ' PHE . 0.0 OUTLIER 70.19 21.58 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.678 0.275 . . . . 0.0 111.06 -179.473 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -110.46 -9.44 14.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.56 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.436 ' CD1' ' CB ' ' A' ' 115' ' ' SER . 35.5 m-85 -128.93 151.39 49.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.745 0.307 . . . . 0.0 110.854 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 4.0 p -61.26 -27.16 68.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 p -160.48 157.6 27.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.968 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.547 HG23 ' CE2' ' A' ' 103' ' ' PHE . 10.9 p -53.18 -31.49 17.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.014 0.435 . . . . 0.0 110.332 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.433 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 25.0 p -68.03 -47.79 67.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.44 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.58 -43.4 84.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.927 0.394 . . . . 0.0 110.254 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.436 ' CB ' ' CD1' ' A' ' 109' ' ' PHE . 47.1 p -57.25 -61.12 2.69 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.594 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 113' ' ' SER . 10.9 ptm180 -54.39 -25.74 26.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.108 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.31 -61.92 1.62 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.277 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.536 ' HD1' ' O ' ' A' ' 118' ' ' TYR . 0.9 OUTLIER -46.26 -43.94 15.99 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.094 0.473 . . . . 0.0 111.61 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.3 t -69.51 -53.73 17.68 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.693 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.7 m -69.07 0.16 5.0 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.644 0.259 . . . . 0.0 111.103 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 6.3 mm-40 . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.422 0.153 . . . . 0.0 110.671 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 17.2 Cg_exo -66.36 160.22 46.44 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.401 2.067 . . . . 0.0 112.423 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.793 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -136.47 141.45 43.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.216 179.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.449 ' HA ' HG22 ' A' ' 96' ' ' VAL . 21.4 t -110.46 126.38 67.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.848 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 50.5 t -86.57 85.52 7.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.369 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.453 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 6.7 mm-40 -46.21 -20.69 0.11 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -178.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.488 ' HB2' ' HB2' ' A' ' 118' ' ' TYR . 0.4 OUTLIER -82.95 -58.7 2.75 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.004 0.431 . . . . 0.0 111.325 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.439 ' HB2' HD12 ' A' ' 95' ' ' ILE . 34.0 m -88.99 -56.93 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.09 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 126.89 -10.37 7.06 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 93' ' ' CYS . 3.9 mt -52.2 155.37 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 88' ' ' ALA . 46.4 t -147.58 125.16 3.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.856 0.36 . . . . 0.0 111.67 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -145.04 -167.8 12.45 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.92 128.46 36.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.48 0.64 . . . . 0.0 111.072 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 101' ' ' ALA . 5.7 mtt180 -33.8 -66.12 0.17 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.311 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -47.31 -6.89 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' ARG . . . -94.96 -50.32 5.16 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.81 179.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -51.46 172.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.447 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.0 t80 -55.01 110.16 0.63 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.921 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.6 p -68.45 -24.84 64.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.4 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 4.5 mttt -55.58 -55.44 31.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.255 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.7 -37.43 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.107 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.29 10.77 7.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.343 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.401 ' O ' ' CD1' ' A' ' 109' ' ' PHE . 37.3 mtm180 -113.48 -3.62 13.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.452 ' CE1' ' HD1' ' A' ' 118' ' ' TYR . 40.6 m-85 -147.33 161.77 40.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.226 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 7.1 p -85.5 24.33 1.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.8 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER 174.15 -175.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.574 0.702 . . . . 0.0 112.409 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 113' ' ' SER . 7.1 p -91.24 -54.51 7.34 Favored 'Isoleucine or valine' 0 C--O 1.25 1.104 0 CA-C-N 114.7 -1.136 . . . . 0.0 109.953 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.56 ' N ' HG13 ' A' ' 112' ' ' VAL . 3.9 p -66.32 -27.41 67.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.493 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.2 t -63.47 -37.81 88.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.769 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 13.3 t -67.83 -67.19 0.48 Allowed 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -21.1 12.2 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.545 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 113' ' ' SER . 4.2 m -73.54 -58.33 3.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 92' ' ' MET . 8.4 t80 -48.22 -35.22 11.48 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.4 t -84.45 -62.65 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.421 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.4 m -58.43 -54.98 40.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.56 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.9 t30 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.08 -179.721 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.406 ' N ' ' HG3' ' A' ' 86' ' ' GLU . . . . . . . . 0 N--CA 1.488 2.147 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.81 -83.2 0.36 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.606 0.241 . . . . 0.0 111.371 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.48 -70.64 0.99 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.59 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.39 69.48 0.09 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.994 0.426 . . . . 0.0 110.65 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 82' ' ' GLY . 4.8 mm-40 -54.29 140.95 53.55 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.998 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 97.3 Cg_endo -84.81 132.33 4.73 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.624 2.216 . . . . 0.0 112.775 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -119.23 102.17 8.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.887 HG13 HG22 ' A' ' 96' ' ' VAL . 11.0 t -79.08 138.28 20.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.788 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -84.2 120.48 26.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.539 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -69.19 -20.54 63.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.838 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.5 -58.26 2.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.767 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.3 m -91.44 -29.68 16.91 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.39 -19.49 53.63 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.574 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.7 mt -54.44 134.36 17.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.815 0.34 . . . . 0.0 111.449 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.887 HG22 HG13 ' A' ' 89' ' ' VAL . 12.8 t -114.93 141.71 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.48 -173.4 20.62 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.978 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 p -89.78 142.65 27.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.75 -42.56 5.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -1.84 16.66 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.41 -28.02 7.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.317 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 0.8 OUTLIER -87.56 160.41 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 111.451 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.93 110.43 0.23 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.347 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.2 m -62.58 -27.31 69.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.397 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 1.1 ttmt -50.76 -60.28 3.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.801 0.334 . . . . 0.0 111.166 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.408 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.6 p -116.96 -40.37 3.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.71 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.423 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 82.93 -21.6 0.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.653 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -68.22 -32.38 72.55 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 25.9 m-85 -119.49 142.97 47.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -66.26 -11.22 48.94 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -152.85 155.27 36.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.887 0.375 . . . . 0.0 111.662 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.434 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.2 p -63.22 -34.06 64.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.065 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 82.5 p -58.94 -44.31 91.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.926 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 54.9 m -58.69 -24.6 61.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.534 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.82 -50.75 10.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.797 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -69.36 -19.28 63.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.407 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 1.4 m -82.1 -51.51 7.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.082 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.0 -26.0 68.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.85 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.37 -46.11 9.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.307 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.02 0.7 54.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.277 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 117' ' ' SER . 55.0 t30 -134.39 0.45 3.06 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.13 -168.82 1.5 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.147 0.498 . . . . 0.0 111.735 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -162.93 150.79 13.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.926 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.896 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.445 -0.262 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.9 p -49.74 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.781 0.324 . . . . 0.0 111.177 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 47.61 -109.93 0.53 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.745 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.442 ' OG ' HG21 ' A' ' 98' ' ' THR . 0.1 OUTLIER -144.59 45.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.897 0.379 . . . . 0.0 110.841 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.8 mm-40 -57.47 116.93 15.47 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.017 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 15.8 Cg_exo -68.38 136.81 37.99 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.58 2.186 . . . . 0.0 112.43 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.97 116.31 22.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.876 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 96' ' ' VAL . 19.6 t -81.49 136.53 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.534 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.2 t -80.07 119.86 23.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.271 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.35 -22.6 66.83 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 2.9 tpt -91.21 -58.26 2.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.06 -29.83 19.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 98.41 -22.04 42.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.266 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.5 mm -54.79 136.34 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.961 0.41 . . . . 0.0 111.085 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.645 HG22 HG22 ' A' ' 89' ' ' VAL . 6.5 t -108.03 139.9 28.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.889 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.465 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.7 158.52 27.72 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.299 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.442 HG21 ' OG ' ' A' ' 85' ' ' SER . 41.2 p -68.99 143.68 54.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.83 0.315 . . . . 0.0 110.399 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -44.84 -41.92 7.47 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.91 -4.37 27.87 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.92 -27.32 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.737 0.303 . . . . 0.0 111.122 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -88.28 158.95 18.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.26 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 2.0 t80 -44.82 118.57 1.66 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.205 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 26.7 t -65.52 -27.0 68.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.542 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.455 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 16.4 tptp -52.32 -49.07 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 7.4 p -128.12 -42.77 1.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.335 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 22.9 mmtm 84.79 -20.88 0.27 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.455 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -75.33 -25.0 57.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.866 0.365 . . . . 0.0 110.616 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.418 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 45.6 m-85 -120.75 133.34 55.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.175 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.5 p -63.02 -12.75 28.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -151.62 153.78 35.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.004 0.43 . . . . 0.0 111.884 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.439 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.0 p -60.95 -35.49 65.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.045 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.5 t -59.62 -40.77 88.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.773 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 8.5 m -60.8 -27.66 68.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.224 179.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 t -74.73 -53.82 8.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.878 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -70.55 -17.58 62.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.59 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.1 m -81.83 -49.24 10.6 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.419 ' CE2' ' O ' ' A' ' 124' ' ' LYS . 1.2 t80 -67.6 -25.25 65.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.778 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -83.93 -50.85 7.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.246 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.0 t -61.15 -51.43 69.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.18 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -88.76 -69.94 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.671 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 68.14 18.34 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.99 4.19 45.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.686 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.419 ' O ' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.901 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.15 -70.75 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 111.067 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 61.92 69.76 1.22 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.529 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.8 m 47.37 60.15 3.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.791 0.329 . . . . 0.0 111.401 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.23 142.03 86.54 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.201 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.33 131.3 3.53 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.887 2.392 . . . . 0.0 112.759 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -116.78 106.65 13.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.906 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.718 HG13 HG22 ' A' ' 96' ' ' VAL . 4.7 t -82.06 126.31 39.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.416 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.33 122.45 22.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.414 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -66.3 -22.15 66.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.78 -58.23 2.55 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 m -86.13 -33.39 20.9 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.18 16.91 54.95 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.425 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.3 mm -90.72 132.87 34.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.423 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.718 HG22 HG13 ' A' ' 89' ' ' VAL . 3.5 t -108.77 135.93 46.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.382 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.36 171.49 30.24 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.288 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 39.0 p -72.45 137.6 46.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.573 0.225 . . . . 0.0 110.581 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.403 ' HG2' ' HG2' ' A' ' 107' ' ' LYS . 20.0 mtp180 -43.27 -40.94 3.72 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.27 0.23 6.79 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -118.97 -19.15 8.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.646 0.26 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.457 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.5 m-85 -93.38 158.84 15.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.154 0.502 . . . . 0.0 111.745 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.453 ' CE2' ' HB3' ' A' ' 105' ' ' LYS . 2.7 t80 -44.63 111.68 0.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.32 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 69.6 m -64.26 -31.16 72.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.426 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.453 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -49.63 -57.29 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.323 . . . . 0.0 111.221 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.572 HG22 ' NE ' ' A' ' 108' ' ' ARG . 0.2 OUTLIER -113.79 -46.1 3.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 85.33 -26.09 0.11 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.424 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.572 ' NE ' HG22 ' A' ' 106' ' ' THR . 14.1 mtm180 -69.86 -32.99 71.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.875 0.369 . . . . 0.0 110.597 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.4 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 22.8 m-85 -118.25 138.48 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.437 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 29.5 p -63.12 -13.73 40.04 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.7 p -150.55 152.96 34.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.975 0.417 . . . . 0.0 111.739 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.408 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.79 -33.75 61.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.991 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 8.0 t -60.7 -37.97 83.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.803 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 109' ' ' PHE . 58.1 m -62.87 -24.7 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.162 179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -50.24 10.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -70.53 -19.52 62.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.398 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 11.3 t -80.98 -51.17 8.82 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.802 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -63.69 -26.01 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.65 179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.0 t -88.47 -43.36 11.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.438 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -87.56 -0.34 56.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.395 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 64.0 m-80 -138.7 2.07 2.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.8 171.57 19.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.206 0.527 . . . . 0.0 111.894 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -171.74 153.76 3.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.995 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.868 179.802 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 t -162.36 141.43 9.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 110.892 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.6 -89.84 0.94 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.516 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.0 p -157.35 60.35 0.5 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.937 0.398 . . . . 0.0 110.795 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -55.53 143.2 58.78 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.182 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.2 Cg_endo -86.53 131.15 3.38 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.885 2.39 . . . . 0.0 112.88 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.817 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -108.89 164.63 12.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.787 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 20.7 t -138.13 126.28 30.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.498 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -73.85 108.88 6.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.076 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.42 ' HG2' ' CZ ' ' A' ' 118' ' ' TYR . 1.9 tp10 -55.26 -19.18 7.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.304 -178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.2 tpt -100.29 -58.68 1.85 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -178.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.83 -30.89 40.52 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 94.09 -21.0 44.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.454 -0.879 . . . . 0.0 112.431 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 33.5 mm -52.49 133.71 14.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.528 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.817 HG13 ' O ' ' A' ' 88' ' ' ALA . 16.4 t -110.43 140.86 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.252 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.33 -167.79 14.74 Favored Glycine 0 C--O 1.227 -0.298 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.802 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 70.4 p -98.38 142.16 30.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.969 0.384 . . . . 0.0 110.339 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HG2' ' NZ ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.65 -42.53 7.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.08 -1.13 16.12 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.06 -31.29 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.862 0.363 . . . . 0.0 111.091 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -81.26 161.12 24.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.334 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.466 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 1.2 t80 -44.69 118.08 1.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.139 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.8 m -71.95 -29.27 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.588 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.466 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 19.5 tptp -57.84 -38.71 76.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.43 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 44.1 p -128.21 -48.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 11.6 mmtp 84.09 -31.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 55.9 mtm180 -62.09 -46.99 86.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.837 0.351 . . . . 0.0 110.28 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -105.17 143.28 33.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.474 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 30.7 p -66.72 -11.01 52.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.6 p -154.06 156.44 37.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.938 0.399 . . . . 0.0 111.689 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.8 p -64.93 -33.73 65.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.91 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 0.2 OUTLIER -58.03 -45.47 86.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.838 179.142 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 95.4 m -59.33 -24.48 63.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.334 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.6 t -76.1 -50.17 15.39 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.726 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -70.39 -21.54 62.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.491 179.257 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -49.27 12.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.886 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 91' ' ' GLU . 1.7 t80 -65.87 -25.88 67.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.873 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.0 p -88.01 -40.06 14.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.132 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 1.1 t -90.43 -4.09 57.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.845 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -140.36 35.55 1.87 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.684 0.278 . . . . 0.0 111.3 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.98 -39.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.147 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -73.12 -64.13 1.04 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.865 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.852 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.441 ' O ' ' CB ' ' A' ' 83' ' ' SER . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 82' ' ' GLY . 4.6 t 84.57 -65.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.728 0.299 . . . . 0.0 110.934 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 53.32 62.05 6.38 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.824 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.3 m 54.1 48.22 21.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.787 0.327 . . . . 0.0 111.301 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 0.3 OUTLIER -54.85 129.46 65.22 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_exo -65.06 126.45 16.49 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.551 2.167 . . . . 0.0 112.697 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -118.0 102.51 9.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.783 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.845 HG13 HG22 ' A' ' 96' ' ' VAL . 7.3 t -79.24 132.74 31.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.432 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 32.2 t -80.41 121.7 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.582 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -69.39 -20.2 63.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.775 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 7.8 tpt -89.52 -58.2 2.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 6.6 m -89.15 -31.7 17.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.09 17.96 51.82 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.523 -0.846 . . . . 0.0 112.473 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mm -91.77 134.05 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.384 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.845 HG22 HG13 ' A' ' 89' ' ' VAL . 3.2 t -109.92 137.51 41.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.182 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.54 -178.05 25.04 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.983 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.7 p -81.87 136.74 35.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.789 0.294 . . . . 0.0 110.249 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mtp180 -43.2 -38.42 2.5 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.64 3.83 3.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.17 -21.05 6.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.688 0.28 . . . . 0.0 111.435 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.8 m-85 -91.07 160.71 15.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.09 0.471 . . . . 0.0 111.504 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.493 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.57 108.23 0.11 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.096 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 t -57.54 -42.54 83.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.842 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.493 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 2.8 mmpp? -46.5 -60.29 2.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.45 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -102.52 -52.41 3.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.048 -179.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.454 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 86.57 -27.31 0.08 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.507 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.94 -32.57 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.9 0.381 . . . . 0.0 110.72 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -117.4 144.41 45.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.644 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.3 p -66.08 -11.36 48.15 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.9 p -154.87 157.38 37.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.902 0.382 . . . . 0.0 111.644 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 10.4 p -65.29 -34.77 72.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.978 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.408 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 62.3 p -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.736 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.71 -22.04 63.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.389 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.88 -48.39 11.59 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 2.4 ptp180 -70.72 -20.59 62.64 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 5.0 t -78.95 -50.7 10.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.465 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 1.9 t80 -63.95 -24.17 67.62 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.529 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.5 p -88.19 -34.39 17.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.805 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 66.4 m -93.81 -6.17 46.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.013 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 58.6 m-80 -137.3 13.57 3.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.465 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -152.6 120.69 6.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.994 0.426 . . . . 0.0 111.202 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 176.9 158.74 0.34 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.798 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.62 -172.88 0.23 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 0.0 110.817 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.04 -85.61 0.75 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.404 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 50.19 1.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 0.0 110.84 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.67 141.1 46.77 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.155 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.403 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 89.1 Cg_endo -85.73 131.58 3.94 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.791 2.327 . . . . 0.0 112.792 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.725 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.81 99.52 7.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.306 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 96' ' ' VAL . 38.5 t -79.08 126.27 38.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.434 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.16 115.22 10.05 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 109' ' ' PHE . 2.4 tt0 -71.59 -21.24 61.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.704 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -13.26 23.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.441 ' HB2' HD12 ' A' ' 95' ' ' ILE . 55.8 m -132.05 -43.69 0.96 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 118.131 0.423 . . . . 0.0 111.666 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 119.35 -32.48 5.05 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.089 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.441 HD12 ' HB2' ' A' ' 93' ' ' CYS . 2.5 mp -52.54 132.33 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.84 0.352 . . . . 0.0 111.855 -179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.689 HG22 HG13 ' A' ' 89' ' ' VAL . 10.9 t -115.55 141.77 31.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.704 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -176.73 23.71 Favored Glycine 0 C--O 1.228 -0.273 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.116 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.9 p -86.99 142.19 28.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.791 0.296 . . . . 0.0 110.292 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.53 -41.56 2.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.167 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.95 -1.58 10.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.04 -17.62 8.95 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 2.2 m-85 -97.2 159.05 15.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.022 0.439 . . . . 0.0 111.669 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.482 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 4.7 t80 -44.93 113.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.9 t -59.91 -39.53 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.776 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -46.68 -60.31 2.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.81 0.338 . . . . 0.0 111.568 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.435 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 22.5 p -106.61 -52.16 2.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.903 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.725 ' O ' ' HB1' ' A' ' 88' ' ' ALA . 0.0 OUTLIER 84.77 -23.07 0.18 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.461 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.0 -27.93 60.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.686 0.279 . . . . 0.0 110.922 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 32.1 m-85 -119.52 137.41 53.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.465 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.414 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 26.9 p -57.68 -15.01 6.49 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.0 p -152.24 154.56 36.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.997 0.427 . . . . 0.0 112.001 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.454 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -63.26 -35.82 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.023 178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.6 p -57.85 -38.97 76.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.614 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.9 m -60.93 -24.41 66.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.347 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 -51.14 10.01 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 ptp85 -70.36 -17.58 63.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.321 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 122' ' ' SER . 2.3 m -83.94 -50.06 8.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.14 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.85 -24.04 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.864 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.1 t -88.11 -49.34 7.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.931 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 2.0 t -77.9 -58.31 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.995 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -93.28 -81.14 0.37 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 117' ' ' SER . 0.2 OUTLIER 167.86 -173.57 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.579 -179.665 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -61.88 -89.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.767 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.911 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.461 -0.256 . . . . 0.0 112.461 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.404 ' O ' ' N ' ' A' ' 85' ' ' SER . 3.0 p -126.02 138.1 53.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 111.165 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.65 77.71 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.388 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.456 ' N ' ' HD3' ' A' ' 99' ' ' ARG . 16.3 t 172.04 39.28 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.007 0.432 . . . . 0.0 109.998 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -96.51 161.99 24.91 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.231 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.27 135.21 22.22 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.019 2.479 . . . . 0.0 112.613 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -124.57 123.02 39.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.638 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.533 HG13 HG22 ' A' ' 96' ' ' VAL . 13.7 t -80.31 144.19 11.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.67 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 48.7 t -90.06 119.79 30.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.476 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.44 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -64.23 -23.52 67.34 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -91.61 -58.17 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.2 m -89.0 -29.33 19.57 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.77 -23.18 37.11 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.978 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.6 mm -53.9 137.12 14.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.933 0.397 . . . . 0.0 111.059 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.533 HG22 HG13 ' A' ' 89' ' ' VAL . 6.2 t -108.53 138.44 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.704 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.72 150.86 22.92 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.086 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 41.0 p -57.61 138.62 55.11 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.456 ' HD3' ' N ' ' A' ' 85' ' ' SER . 2.6 ptm180 -46.52 -36.52 6.82 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -70.26 0.67 5.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.55 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.58 -19.41 7.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.318 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 110' ' ' CYS . 1.6 m-85 -92.08 158.07 16.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 105' ' ' LYS . 2.2 t80 -45.2 115.35 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.113 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 33.4 p -62.8 -28.9 70.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.555 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HB3' ' CD2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -54.12 -60.5 3.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 0.0 111.187 -179.602 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.442 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 0.6 OUTLIER -107.34 -46.25 3.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.078 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.97 -26.68 0.1 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.515 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 7.5 mtm-85 -71.97 -23.05 61.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.78 0.324 . . . . 0.0 110.981 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 91' ' ' GLU . 24.7 m-85 -121.58 140.72 51.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.6 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 30.2 p -66.94 -12.14 58.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.46 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.5 p -152.91 154.85 35.88 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.441 . . . . 0.0 112.059 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.448 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.7 p -62.91 -35.57 71.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.911 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.2 p -58.21 -40.63 82.13 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.792 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.56 -24.53 65.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.406 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -79.91 -49.36 12.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -20.66 62.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.408 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 5.6 m -80.25 -52.02 8.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.782 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.492 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 1.4 t80 -63.7 -25.89 68.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.715 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -88.69 -42.86 11.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.429 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 5.6 t -88.71 -2.02 58.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.247 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -139.82 0.95 1.84 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.492 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.8 OUTLIER -148.78 153.52 38.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.141 0.496 . . . . 0.0 111.664 -179.811 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt 51.39 70.67 0.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.87 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.0 t 67.41 153.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.795 0.331 . . . . 0.0 110.829 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.35 21.69 31.54 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.542 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.1 p -145.0 46.15 1.34 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.877 0.37 . . . . 0.0 110.639 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.11 116.95 25.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.919 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -61.52 133.03 43.53 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.51 2.14 . . . . 0.0 112.442 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -121.84 114.24 20.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.545 HG13 HG22 ' A' ' 96' ' ' VAL . 19.7 t -78.99 135.27 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.432 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 38.6 t -80.97 120.18 24.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.744 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.456 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -67.43 -21.39 65.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.971 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -58.32 2.53 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.3 m -90.85 -27.72 18.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.46 -19.91 52.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.485 -0.865 . . . . 0.0 112.146 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.3 mm -57.76 142.16 13.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.987 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.545 HG22 HG13 ' A' ' 89' ' ' VAL . 4.3 t -115.67 142.91 26.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.952 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.34 161.03 28.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.112 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 71.1 p -69.26 140.11 54.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.447 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 12.5 ptm180 -41.58 -41.25 2.11 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -71.31 0.66 7.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.94 -21.15 6.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.577 0.227 . . . . 0.0 111.594 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.4 m-85 -92.64 161.25 14.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.933 0.397 . . . . 0.0 111.33 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.463 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 3.3 t80 -44.65 100.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.082 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.9 m -55.98 -25.01 42.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.731 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.463 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 1.1 tptp -54.4 -59.83 4.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 111.044 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.437 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.0 OUTLIER -117.19 -40.64 3.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.84 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 84.32 -17.52 0.46 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.663 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -61.68 -46.09 91.23 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.781 0.324 . . . . 0.0 110.588 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 9.0 m-85 -108.44 160.26 16.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.55 -5.78 49.09 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -161.6 164.33 29.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.098 0.475 . . . . 0.0 112.062 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 113' ' ' SER . 9.2 p -66.6 -44.58 89.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.299 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 112' ' ' VAL . 55.1 p -57.94 -36.11 72.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.853 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -67.23 -18.96 65.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.498 178.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 7.0 p -85.88 -46.73 10.32 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.623 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -74.78 -20.74 59.68 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.527 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 39.6 m -81.32 -53.63 6.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.52 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.456 ' CE1' ' HB3' ' A' ' 91' ' ' GLU . 15.7 t80 -67.15 -20.06 65.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.149 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -88.23 -49.86 6.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.203 0.525 . . . . 0.0 110.894 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.0 t -80.22 6.3 12.21 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.761 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.527 ' HB2' ' O ' ' A' ' 117' ' ' SER . 2.2 m-80 -101.2 12.78 36.91 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.825 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.1 t 58.76 77.76 0.29 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.824 0.345 . . . . 0.0 110.784 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -64.88 -76.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.909 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.3 tttm . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.963 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.4 163.89 1.64 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 69.19 71.56 0.97 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.532 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 p 42.94 68.95 0.43 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.765 0.317 . . . . 0.0 111.671 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -60.17 142.94 89.31 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.757 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 83.9 Cg_endo -82.25 128.62 5.66 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.76 2.307 . . . . 0.0 113.277 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.822 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -106.5 169.85 8.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.814 178.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -139.29 126.32 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.84 0.352 . . . . 0.0 111.908 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 35.5 t -78.51 114.63 17.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.399 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -63.68 -18.63 64.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.244 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.5 tpt -94.38 -58.37 2.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.7 m -88.18 -25.37 22.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.13 22.13 61.54 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.385 -0.912 . . . . 0.0 112.24 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.9 mm -89.69 128.45 41.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.79 0.328 . . . . 0.0 110.479 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.822 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.1 t -103.65 134.56 44.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.15 -169.1 15.89 Favored Glycine 0 C--O 1.228 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.122 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.7 p -95.3 137.25 34.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 0.0 110.766 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.436 ' HG2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -43.58 -40.46 4.04 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.8 3.39 8.15 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.02 -28.61 4.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.732 0.301 . . . . 0.0 111.436 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 110' ' ' CYS . 0.4 OUTLIER -79.09 161.53 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 111.82 -179.407 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 105' ' ' LYS . 2.3 t80 -44.67 106.4 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.237 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 47.5 m -62.94 -25.43 68.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.536 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -51.49 -60.39 3.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.778 0.323 . . . . 0.0 111.139 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.441 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.2 p -113.5 -36.76 4.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.441 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.1 OUTLIER 84.57 -34.25 0.06 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.494 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.59 -51.06 68.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.819 0.342 . . . . 0.0 110.685 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -101.93 140.71 35.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.652 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 102' ' ' PHE . 31.3 p -64.18 -14.45 55.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.107 -0.497 . . . . 0.0 112.31 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.1 p -151.67 154.22 35.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.842 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.429 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.2 p -63.16 -32.77 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.746 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' ARG . 4.2 t -57.74 -44.69 86.21 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.741 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 65.2 m -59.65 -27.67 66.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.171 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 t -72.12 -55.29 7.56 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.978 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -69.28 -18.1 63.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.907 0.384 . . . . 0.0 110.122 178.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 121' ' ' ASN . 1.8 m -79.55 -54.02 6.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -61.17 -24.77 66.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.079 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 9.8 t -83.23 -52.93 6.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.512 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -50.9 8.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' A' ' 117' ' ' SER . 37.8 t30 -67.15 -5.16 12.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 49.7 m 50.44 87.14 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.65 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.442 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.2 tttt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.913 -179.851 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.409 ' HA2' ' CG ' ' A' ' 86' ' ' GLU . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -148.16 -70.02 0.22 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.731 0.301 . . . . 0.0 111.502 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -45.09 -72.25 0.39 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.221 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -174.69 78.22 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.843 0.354 . . . . 0.0 110.843 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 3.5 mm-40 -50.9 134.84 28.29 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.374 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 6.2 Cg_exo -77.86 131.54 11.22 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.359 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -120.35 98.93 6.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.69 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.801 HG13 HG22 ' A' ' 96' ' ' VAL . 11.6 t -79.74 133.76 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.249 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 22.1 t -78.08 118.66 20.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.646 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.5 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 7.1 mm-40 -65.79 -20.51 66.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.852 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -58.23 2.47 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.479 ' HB2' HD13 ' A' ' 95' ' ' ILE . 5.7 m -88.58 -31.89 18.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.05 19.28 43.42 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.865 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.479 HD13 ' HB2' ' A' ' 93' ' ' CYS . 3.2 mp -89.96 128.39 41.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 0.0 110.116 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.801 HG22 HG13 ' A' ' 89' ' ' VAL . 4.8 t -103.71 137.3 32.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.253 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.51 -174.96 22.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.766 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 p -90.49 143.17 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.952 0.376 . . . . 0.0 110.333 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 6.7 ptm180 -43.96 -42.23 5.8 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -71.67 0.01 9.79 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -114.91 -28.27 7.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.676 0.274 . . . . 0.0 111.321 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.405 ' CD2' ' HA ' ' A' ' 110' ' ' CYS . 1.5 m-85 -87.96 160.08 18.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.448 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 2.2 t80 -44.98 105.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.4 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.4 p -57.43 -26.4 61.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.435 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.448 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -53.62 -60.04 3.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.163 -179.795 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.431 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 1.3 p -115.1 -43.55 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 106' ' ' THR . 0.0 OUTLIER 83.57 -21.32 0.28 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.498 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -67.69 -34.07 76.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.74 0.305 . . . . 0.0 110.834 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.486 ' CE2' ' CD2' ' A' ' 118' ' ' TYR . 19.2 m-85 -118.42 148.22 42.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.502 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.405 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 14.9 p -66.83 -7.6 22.72 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.4 p -163.31 166.16 23.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.928 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 113' ' ' SER . 10.6 p -66.66 -46.19 86.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.453 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.496 ' N ' HG13 ' A' ' 112' ' ' VAL . 11.5 p -56.99 -39.69 75.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.14 0.495 . . . . 0.0 109.815 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 109' ' ' PHE . 1.6 t -63.71 -18.91 64.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.478 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.1 t -85.56 -47.17 10.13 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -73.24 -19.73 61.01 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 8.4 t -82.19 -53.38 6.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.476 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.5 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 14.4 t80 -65.19 -20.45 66.45 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.141 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.4 t -87.99 -50.37 6.46 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.488 . . . . 0.0 110.632 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.3 m -81.48 3.61 24.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.071 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 117' ' ' SER . 0.8 OUTLIER -89.36 -1.11 57.94 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 54.99 77.31 0.22 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.907 0.384 . . . . 0.0 110.812 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -63.6 -46.33 86.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.174 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.009 -179.83 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -168.1 149.91 5.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.881 0.372 . . . . 0.0 110.947 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.96 -177.91 38.85 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.982 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 77.36 -34.11 0.2 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -47.59 128.3 10.65 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.93 136.9 3.74 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.979 2.452 . . . . 0.0 112.427 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 107' ' ' LYS . . . -115.73 108.25 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.731 HG13 HG22 ' A' ' 96' ' ' VAL . 9.8 t -81.62 128.08 39.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -75.43 120.43 20.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.535 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.454 ' HG2' ' CE1' ' A' ' 118' ' ' TYR . 1.5 tt0 -68.28 -17.77 64.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.719 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 9.6 tpt -92.62 -58.14 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 8.9 m -88.18 -31.99 18.83 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 -178.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.73 19.01 49.87 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.254 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -93.82 132.98 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 120.951 0.405 . . . . 0.0 110.063 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.731 HG22 HG13 ' A' ' 89' ' ' VAL . 2.9 t -105.04 133.47 49.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.387 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.57 151.59 23.59 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.833 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.6 p -59.14 140.31 56.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.019 0.41 . . . . 0.0 110.604 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.402 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 32.2 ptt85 -44.56 -33.9 1.93 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.24 -0.436 . . . . 0.0 112.007 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -68.13 -2.9 8.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.07 -1.13 7.77 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -109.55 158.06 18.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.178 0.513 . . . . 0.0 111.73 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.472 ' CE2' ' HB2' ' A' ' 105' ' ' LYS . 3.9 t80 -44.43 100.59 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.178 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.4 OUTLIER -49.87 -28.39 6.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.884 -179.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB2' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -50.44 -54.64 20.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.848 0.356 . . . . 0.0 111.216 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 2.1 p -128.01 -38.01 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.147 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 106' ' ' THR . 8.3 mmtp 81.27 -9.52 1.29 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.535 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -68.85 -34.29 75.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.601 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -118.35 143.74 46.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.604 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.1 p -63.7 -13.09 40.05 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -155.8 158.27 37.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.988 0.423 . . . . 0.0 111.907 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.4 p -65.73 -36.06 76.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.837 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 60.7 p -58.15 -39.2 78.2 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.568 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.67 -21.58 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.367 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.6 p -82.34 -48.41 11.19 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.673 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.401 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 27.5 ptt180 -71.95 -19.68 61.86 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.422 ' O ' ' N ' ' A' ' 121' ' ' ASN . 4.0 m -79.06 -51.88 8.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.458 ' CD2' ' HB3' ' A' ' 122' ' ' SER . 1.9 t80 -63.56 -23.58 67.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.554 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 16.6 p -88.37 -35.74 16.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.739 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.6 t -92.59 -6.16 50.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.981 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 117' ' ' SER . 71.3 m-80 -134.64 5.34 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.458 ' HB3' ' CD2' ' A' ' 118' ' ' TYR . 0.1 OUTLIER -145.78 129.63 17.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.913 0.387 . . . . 0.0 111.027 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.23 146.14 30.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.875 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.862 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -76.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.987 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 58.25 -148.46 36.98 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.539 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.41 ' HA ' ' NE ' ' A' ' 99' ' ' ARG . 21.7 p -134.02 46.91 2.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 0.0 110.771 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.13 146.75 33.32 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.408 ' HB2' ' CG1' ' A' ' 96' ' ' VAL . 92.2 Cg_endo -85.24 149.47 10.48 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.865 2.377 . . . . 0.0 112.546 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.455 ' C ' HG13 ' A' ' 96' ' ' VAL . . . -124.71 120.9 33.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.955 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.513 HG22 ' CG2' ' A' ' 96' ' ' VAL . 22.0 t -79.11 137.74 21.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.624 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 39.0 t -81.16 114.9 20.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.96 -22.1 62.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -95.9 -58.31 2.13 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.595 ' HB2' HD12 ' A' ' 95' ' ' ILE . 4.4 m -89.29 -28.98 19.51 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.12 -24.32 32.32 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.474 -179.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 93' ' ' CYS . 4.5 mp -52.71 138.1 11.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.914 0.388 . . . . 0.0 111.01 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.513 ' CG2' HG22 ' A' ' 89' ' ' VAL . 8.7 t -113.33 141.3 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.666 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.404 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.73 156.12 26.52 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.116 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.6 p -65.8 142.71 57.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.516 ' HB2' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -44.41 -34.96 2.2 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.442 ' N ' ' HG2' ' A' ' 99' ' ' ARG . 2.7 tp10 -74.17 -0.68 17.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.24 -18.9 7.25 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.404 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 1.5 m-85 -91.97 161.38 14.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.49 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.7 t80 -44.7 97.28 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.203 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.421 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 9.0 t -47.74 -28.88 2.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.064 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 0.8 OUTLIER -54.43 -60.42 3.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 p -119.64 -39.25 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HE2' ' HB2' ' A' ' 99' ' ' ARG . 0.0 OUTLIER 81.64 -14.15 0.82 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.719 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -64.19 -39.34 93.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.758 0.313 . . . . 0.0 110.549 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 115' ' ' SER . 11.5 m-85 -112.07 153.51 26.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.386 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.5 p -68.39 -7.69 33.72 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -165.53 168.41 16.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.051 0.453 . . . . 0.0 111.94 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.466 HG13 ' N ' ' A' ' 113' ' ' SER . 10.2 p -68.12 -43.27 85.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.237 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.466 ' N ' HG13 ' A' ' 112' ' ' VAL . 16.6 t -57.66 -40.61 79.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.8 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.34 -19.06 65.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.563 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.435 ' HA ' ' CD1' ' A' ' 109' ' ' PHE . 4.9 p -84.29 -45.35 12.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.53 179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -74.21 -19.84 60.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.848 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.8 t -80.81 -53.88 6.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.584 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.404 ' HD1' ' CZ ' ' A' ' 109' ' ' PHE . 10.1 t80 -66.72 -22.39 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.999 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 t -88.31 -48.78 7.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.917 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.6 m -81.12 2.88 25.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.146 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -140.16 -0.2 1.66 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.94 155.58 43.5 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.871 0.367 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.02 146.17 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.931 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.291 -0.861 . . . . 0.0 111.017 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 112.584 -0.207 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -75.11 -76.62 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.881 0.372 . . . . 0.0 110.758 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -165.89 129.14 1.88 Allowed Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.4 t 63.06 50.44 3.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.143 0.497 . . . . 0.0 109.689 -178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.12 162.33 75.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.448 -179.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 85.1 Cg_endo -84.94 128.42 3.75 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.857 2.371 . . . . 0.0 112.79 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.787 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -110.02 167.3 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.571 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.1 t -137.95 126.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.591 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.73 110.53 8.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.495 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 6.5 mp0 -58.38 -21.13 49.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.2 tpt -96.9 -58.52 2.01 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -82.96 -27.85 30.2 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 82.6 20.89 60.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.095 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -88.72 129.07 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 88' ' ' ALA . 6.0 t -104.93 136.35 38.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.839 0.352 . . . . 0.0 111.328 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.43 -169.68 16.73 Favored Glycine 0 C--O 1.227 -0.289 0 N-CA-C 111.736 -0.546 . . . . 0.0 111.736 179.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.6 p -91.43 136.65 32.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.083 0.441 . . . . 0.0 110.137 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.46 ' HA ' ' CE ' ' A' ' 107' ' ' LYS . 20.7 mtp85 -42.9 -38.43 2.19 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.66 9.19 5.32 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.76 -34.66 4.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.999 0.428 . . . . 0.0 110.856 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -74.09 161.4 30.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 112.075 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 107' ' ' LYS . 4.6 t80 -44.34 152.16 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.886 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.1 m -96.16 -46.2 6.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.315 . . . . 0.0 111.559 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.456 ' HB3' ' CE2' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -47.8 -49.52 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -179.299 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.404 ' O ' ' CB ' ' A' ' 107' ' ' LYS . 74.1 p -105.29 -49.0 3.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.33 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 103' ' ' PHE . 0.1 OUTLIER 82.95 -46.73 0.14 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.157 -179.632 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -60.88 -45.28 95.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.984 0.421 . . . . 0.0 110.487 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -96.88 145.38 25.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -68.73 -9.65 51.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.7 p -155.96 158.41 37.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.956 0.408 . . . . 0.0 111.757 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.452 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 9.0 p -63.96 -36.48 76.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.896 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.4 t -57.27 -44.05 83.63 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.731 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.7 m -60.0 -26.13 65.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.017 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 p -73.46 -52.21 14.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -69.55 -20.81 63.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.245 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.85 -53.1 7.44 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.996 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.495 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.8 t80 -63.74 -25.15 68.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.987 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.5 t -81.26 -55.48 4.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.6 m -79.44 -52.42 8.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.47 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.17 -0.86 20.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.737 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 m 56.5 -158.91 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.711 0.291 . . . . 0.0 111.346 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.422 ' HD2' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -125.99 110.48 13.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.897 -179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.5 tptt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.941 179.894 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 97.4 p -50.86 -69.15 0.12 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.724 0.297 . . . . 0.0 111.574 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -101.68 71.32 0.37 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.361 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 46.87 59.32 4.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.924 0.393 . . . . 0.0 111.483 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -65.97 122.61 81.91 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.053 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.27 129.69 29.35 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.46 2.107 . . . . 0.0 112.661 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -115.93 109.7 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.615 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.711 HG13 HG22 ' A' ' 96' ' ' VAL . 11.3 t -82.29 131.71 33.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.834 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 45.1 t -79.43 119.81 22.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.44 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.477 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.2 mt-10 -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.1 tpt -88.52 -58.26 2.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 11.7 m -86.96 -35.6 18.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.679 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.99 -26.45 23.09 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.102 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -52.61 132.6 14.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 111.229 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.711 HG22 HG13 ' A' ' 89' ' ' VAL . 11.7 t -106.67 139.05 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.242 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.452 ' HA3' ' CE1' ' A' ' 102' ' ' PHE . . . -150.24 151.56 23.59 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 72.2 p -61.34 140.0 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.571 0.224 . . . . 0.0 110.895 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -39.85 -45.46 1.81 Allowed 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -67.04 -1.15 3.8 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.42 -10.66 9.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.63 0.252 . . . . 0.0 111.371 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.452 ' CE1' ' HA3' ' A' ' 97' ' ' GLY . 1.6 m-85 -105.45 159.09 16.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.208 0.527 . . . . 0.0 111.41 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.459 ' CE1' ' CB ' ' A' ' 105' ' ' LYS . 5.1 t80 -44.63 104.43 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.185 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.2 m -54.43 -35.29 62.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.875 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.459 ' CB ' ' CE1' ' A' ' 103' ' ' PHE . 0.3 OUTLIER -47.92 -60.36 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.728 0.299 . . . . 0.0 111.434 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.518 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 33.0 p -111.0 -46.39 3.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.717 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 106' ' ' THR . 6.4 mmtp 80.33 -15.67 0.73 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.841 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -74.56 -27.59 60.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.908 0.385 . . . . 0.0 110.394 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -123.54 140.0 53.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.516 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 102' ' ' PHE . 25.1 p -60.16 -13.79 14.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.2 p -151.74 154.41 36.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.918 0.39 . . . . 0.0 111.859 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.446 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 10.3 p -62.56 -36.27 74.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 8.8 t -58.67 -40.08 82.51 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.733 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 118' ' ' TYR . 9.9 m -61.77 -23.76 66.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.303 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.3 p -79.33 -52.94 7.44 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.763 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 113' ' ' SER . 16.4 ptt-85 -70.05 -17.66 63.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.281 178.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.423 ' O ' ' ND2' ' A' ' 121' ' ' ASN . 4.6 m -82.79 -47.95 11.34 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.819 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 2.5 t80 -69.89 -21.59 63.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.934 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 p -88.18 -60.49 1.95 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.506 ' C ' ' H ' ' A' ' 122' ' ' SER . 42.6 m -57.83 -44.03 86.18 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.035 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.423 ' ND2' ' O ' ' A' ' 117' ' ' SER . 0.0 OUTLIER -70.31 22.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.506 ' H ' ' C ' ' A' ' 120' ' ' SER . 0.3 OUTLIER 46.66 90.27 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 179.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.3 -44.33 92.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.511 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.964 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.414 -0.275 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.71 -37.36 3.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.85 0.357 . . . . 0.0 111.024 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 53.02 38.37 55.54 Favored Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.745 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.84 97.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.565 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.84 117.02 66.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.006 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.579 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 34.5 Cg_exo -60.76 124.12 14.36 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.556 2.171 . . . . 0.0 112.21 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.41 ' O ' ' CE2' ' A' ' 102' ' ' PHE . . . -110.32 100.97 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 95' ' ' ILE . 16.7 t -79.11 140.19 17.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.914 0.388 . . . . 0.0 111.479 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.15 121.54 19.47 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -76.14 11.45 1.49 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.361 -0.836 . . . . 0.0 113.073 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 6.7 tpt -116.52 -55.23 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.454 ' HB2' ' CD1' ' A' ' 95' ' ' ILE . 6.4 m -96.06 -47.7 5.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.836 -1.074 . . . . 0.0 110.429 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 114.35 6.33 20.15 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.762 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.0 mm -52.35 -177.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.762 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.2 t -142.67 142.41 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 CA-C-O 121.306 0.574 . . . . 0.0 111.571 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' A' ' 87' ' ' PRO . . . -150.99 -167.91 15.14 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.115 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.47 ' OG1' ' HB3' ' A' ' 101' ' ' ALA . 0.2 OUTLIER -108.9 155.65 20.59 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 178.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -42.49 -36.43 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -99.18 -38.06 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.47 ' HB3' ' OG1' ' A' ' 98' ' ' THR . . . -62.75 -15.32 52.79 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.497 ' CD1' ' HA3' ' A' ' 97' ' ' GLY . 0.3 OUTLIER -95.33 177.09 5.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.002 0.43 . . . . 0.0 111.486 -179.585 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 105' ' ' LYS . 10.3 t80 -61.53 120.64 10.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.138 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 87.0 p -70.85 -57.6 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -41.54 -29.96 0.19 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' ' 108' ' ' ARG . 2.8 m -126.3 -53.25 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 111.573 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 103' ' ' PHE . 0.0 OUTLIER 71.98 11.1 6.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.216 -179.597 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.613 ' HB2' HG22 ' A' ' 106' ' ' THR . 0.1 OUTLIER -103.31 -33.73 9.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.0 110.863 179.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -116.85 164.16 15.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.172 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 1.1 p -59.76 -38.13 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.999 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 p -150.34 154.09 37.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 0.0 111.575 -178.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.471 ' HB ' ' CZ ' ' A' ' 103' ' ' PHE . 13.9 p -49.69 -34.22 8.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.274 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.435 ' O ' ' HG3' ' A' ' 116' ' ' ARG . 5.9 t -65.66 -45.28 83.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.401 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t -57.34 -44.9 84.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.433 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.0 t -58.9 -63.15 1.4 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.649 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -51.47 -26.15 7.72 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.941 0.4 . . . . 0.0 110.187 179.322 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 1.8 t -68.51 -57.22 6.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -48.23 -39.6 21.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.938 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 8.1 t -68.19 -53.91 21.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.543 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 47.0 m -75.38 -3.05 31.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.091 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -112.62 -23.89 9.97 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.654 0.264 . . . . 0.0 111.291 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.0 t -167.57 171.11 10.59 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.959 0.409 . . . . 0.0 111.163 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.45 134.18 12.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.831 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.978 -179.947 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 50.28 -134.02 28.82 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.765 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.6 p -134.19 40.27 3.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.909 0.385 . . . . 0.0 110.739 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.5 116.87 49.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.865 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 97' ' ' GLY . 27.7 Cg_exo -62.04 138.89 75.82 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.455 2.104 . . . . 0.0 112.364 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 96' ' ' VAL . . . -134.13 129.41 35.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.74 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 96' ' ' VAL . 17.8 t -87.45 134.02 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.199 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 46.9 t -73.7 121.64 21.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.109 0.481 . . . . 0.0 110.772 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.521 ' HB3' ' CE2' ' A' ' 118' ' ' TYR . 2.6 mm-40 -63.25 -25.82 68.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.715 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.98 -58.38 2.49 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.14 -33.6 19.37 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.07 16.91 45.55 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.616 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.2 mm -91.57 134.44 30.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.714 HG22 HG22 ' A' ' 89' ' ' VAL . 2.9 t -99.23 137.6 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.348 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.435 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.57 -168.05 15.08 Favored Glycine 0 C--N 1.332 0.346 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.953 179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 74.8 p -104.32 140.71 37.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.644 0.259 . . . . 0.0 110.527 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.36 -37.47 3.37 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -78.82 7.71 6.64 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -179.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -122.87 -33.19 3.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.852 0.358 . . . . 0.0 111.344 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.474 ' CG ' ' HA ' ' A' ' 110' ' ' CYS . 2.4 m-30 -74.41 162.29 28.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.722 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 110' ' ' CYS . 8.0 t80 -55.88 89.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.433 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.1 m -41.33 -31.73 0.25 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.564 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.496 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 2.1 tppt? -46.04 -46.47 16.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 107' ' ' LYS . 1.1 p -122.81 -37.11 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.066 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 106' ' ' THR . 10.9 mmtp 78.14 -36.94 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.684 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -62.04 -32.49 73.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.412 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.693 ' HB3' ' SG ' ' A' ' 114' ' ' CYS . 31.6 m-85 -114.39 129.84 56.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.411 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 103' ' ' PHE . 1.8 p -48.64 -63.03 1.2 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.994 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.3 p -106.8 165.85 11.02 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.313 0.578 . . . . 0.0 112.434 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.422 ' HB ' ' CE1' ' A' ' 103' ' ' PHE . 10.8 p -70.95 -26.29 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.021 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.409 ' HA ' ' HG2' ' A' ' 116' ' ' ARG . 71.1 p -66.77 -55.02 16.83 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.2 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.693 ' SG ' ' HB3' ' A' ' 109' ' ' PHE . 30.5 p -59.25 -21.17 59.18 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.431 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 5.3 p -77.65 -50.97 11.39 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.526 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 113' ' ' SER . 7.9 ptp85 -64.98 -19.66 66.09 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' A' ' 121' ' ' ASN . 1.1 m -74.6 -54.18 7.96 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.521 ' CE2' ' HB3' ' A' ' 91' ' ' GLU . 1.3 t80 -57.22 -26.46 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 178.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 55.2 p -85.35 -32.91 22.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.027 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.2 t -104.15 -8.43 19.44 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 117' ' ' SER . 3.9 m-80 -88.93 0.76 56.34 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m 61.13 79.64 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.822 0.344 . . . . 0.0 111.032 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.5 tptt 52.28 86.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 27.7 tptt . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.904 179.831 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 112.525 -0.23 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.58 101.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 111.049 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -144.24 -82.47 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.89 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.1 m -86.41 76.75 9.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.988 0.423 . . . . 0.0 110.085 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -104.84 116.51 60.72 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.242 177.705 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -92.13 115.61 0.37 Allowed 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.491 2.127 . . . . 0.0 112.594 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.602 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -109.05 160.81 15.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.58 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.454 HG22 HG13 ' A' ' 96' ' ' VAL . 21.6 t -139.77 127.49 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.796 0.331 . . . . 0.0 111.408 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 24.0 t -80.07 113.62 18.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.482 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.85 -21.42 56.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.6 tpt -94.97 -58.46 2.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 22.6 m -80.44 -27.24 38.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.5 17.77 75.08 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.46 -0.876 . . . . 0.0 111.766 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.6 mm -89.14 132.42 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 CA-C-O 121.032 0.444 . . . . 0.0 110.476 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.602 HG13 ' O ' ' A' ' 88' ' ' ALA . 2.7 t -99.67 130.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.531 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.464 ' HA3' ' CE2' ' A' ' 102' ' ' PHE . . . -150.65 150.63 22.66 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.957 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 67.9 p -57.82 143.11 43.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 0.0 111.014 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.409 ' CG ' ' HE2' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -45.29 -47.58 13.03 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.667 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.62 -11.51 35.89 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.03 -20.69 13.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.957 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.464 ' CE2' ' HA3' ' A' ' 97' ' ' GLY . 2.1 m-85 -96.84 156.56 16.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.324 0.583 . . . . 0.0 112.026 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.483 ' CE1' ' HD3' ' A' ' 105' ' ' LYS . 2.7 t80 -43.72 96.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.991 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . 83.6 p -56.74 -26.17 56.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.155 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HD3' ' CE1' ' A' ' 103' ' ' PHE . 0.1 OUTLIER -47.79 -51.57 22.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.727 0.298 . . . . 0.0 111.274 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.24 -24.14 3.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 104' ' ' SER . 14.6 mmtm 61.14 54.19 3.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.362 0.601 . . . . 0.0 109.728 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 108' ' ' ARG . 45.0 mtp85 -124.68 -66.05 1.0 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.555 1.169 . . . . 0.0 108.63 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.458 ' HB3' ' CB ' ' A' ' 114' ' ' CYS . 15.1 m-85 -100.65 145.65 28.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 112.71 -2.041 . . . . 0.0 110.449 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 102' ' ' PHE . 28.4 p -64.34 -10.03 21.7 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 9.7 p -151.65 154.18 35.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.574 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 9.9 p -61.55 -33.68 58.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.327 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.5 t -63.43 -41.77 98.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.106 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.458 ' CB ' ' HB3' ' A' ' 109' ' ' PHE . 63.9 m -62.51 -28.03 69.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -51.8 9.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.778 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 120' ' ' SER . 0.1 OUTLIER -68.16 -19.19 64.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.403 179.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 121' ' ' ASN . 4.9 m -82.76 -47.09 12.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.95 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 122' ' ' SER . 2.0 t80 -66.26 -25.04 66.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.779 179.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.8 t -85.68 -54.56 4.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.476 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 116' ' ' ARG . 3.2 m -80.41 4.42 18.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.088 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 117' ' ' SER . 35.6 t30 -142.15 3.94 1.6 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.458 ' HB3' ' CD1' ' A' ' 118' ' ' TYR . 0.2 OUTLIER -154.12 173.09 16.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.15 0.5 . . . . 0.0 111.738 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -170.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.824 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.806 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.43 127.28 50.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.016 0.436 . . . . 0.0 111.204 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 160.37 19.93 0.03 OUTLIER Glycine 0 CA--C 1.524 0.62 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.862 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.48 ' O ' HG22 ' A' ' 98' ' ' THR . 0.3 OUTLIER -130.76 -6.79 4.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 117.355 0.577 . . . . 0.0 111.383 179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.53 116.97 4.03 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.53 -178.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.48 ' HB3' HG12 ' A' ' 96' ' ' VAL . 50.3 Cg_exo -56.41 145.91 76.54 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.946 2.431 . . . . 0.0 112.782 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -119.79 126.5 51.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.321 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.8 126.28 41.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 111.314 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 116.49 17.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.259 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -59.29 -28.39 66.72 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.441 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.6 tpt -90.67 -58.23 2.55 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.554 ' HB3' HD11 ' A' ' 95' ' ' ILE . 10.3 m -83.94 -41.71 17.05 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.618 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 101.37 9.0 45.51 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.787 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.721 HG22 ' H ' ' A' ' 96' ' ' VAL . 1.5 mm -56.17 179.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 95' ' ' ILE . 3.0 t -149.41 113.99 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.364 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -150.19 144.77 12.32 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.49 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 85' ' ' SER . 4.6 p -62.75 138.71 58.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -31.43 -45.59 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -64.35 3.79 0.43 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 98' ' ' THR . . . -134.14 20.91 3.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.702 0.287 . . . . 0.0 110.914 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -132.06 155.28 48.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.022 0.439 . . . . 0.0 111.575 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.425 ' CE2' ' CB ' ' A' ' 105' ' ' LYS . 3.0 t80 -44.5 99.21 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.935 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.53 -27.18 15.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.927 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.425 ' CB ' ' CE2' ' A' ' 103' ' ' PHE . 6.8 tptp -47.8 -59.29 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 111.022 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.1 p -122.48 -33.96 3.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.94 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.18 -4.59 2.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.445 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 21.8 mtp180 -83.88 -24.97 30.6 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.854 0.359 . . . . 0.0 110.757 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -126.93 138.91 53.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.37 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.4 p -63.16 -12.95 31.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.3 p -156.25 159.14 38.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.81 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.31 -33.41 63.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 178.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 t -57.54 -41.76 81.6 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.327 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.87 -21.26 63.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.308 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.8 t -79.88 -51.67 8.84 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.135 0.493 . . . . 0.0 110.143 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -67.79 -17.47 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 7.4 t -82.38 -52.37 6.97 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.686 178.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.496 ' CE2' ' HG2' ' A' ' 123' ' ' LYS . 5.6 t80 -60.32 -22.88 63.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.704 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.28 -43.4 11.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.205 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 38.7 m -82.85 -54.63 4.95 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' O ' ' A' ' 122' ' ' SER . 18.7 m-80 -64.65 -5.73 6.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.525 ' O ' ' O ' ' A' ' 121' ' ' ASN . 70.4 m 35.32 107.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.496 ' HG2' ' CE2' ' A' ' 118' ' ' TYR . 0.0 OUTLIER -77.55 -43.84 30.54 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.92 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' ' CB ' ' A' ' 83' ' ' SER . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.484 -0.246 . . . . 0.0 112.484 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 82' ' ' GLY . 1.7 p 163.05 -88.51 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.627 0.251 . . . . 0.0 110.791 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.82 48.39 2.27 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.51 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.8 p -114.89 9.97 16.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.565 0.221 . . . . 0.0 111.208 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 4.6 mt-10 -92.13 116.8 67.12 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.882 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 4.6 Cg_exo -74.46 148.15 37.49 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.703 2.269 . . . . 0.0 112.215 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.708 ' HB3' ' CE2' ' A' ' 102' ' ' PHE . . . -143.02 136.22 28.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.227 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.618 HG12 ' HA2' ' A' ' 94' ' ' GLY . 17.0 t -90.9 133.8 31.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 20.3 t -64.9 124.82 23.01 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.457 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -69.52 3.83 2.16 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -118.41 -52.17 2.38 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.577 0.703 . . . . 0.0 109.862 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.472 ' CB ' HD11 ' A' ' 95' ' ' ILE . 5.9 m -96.9 -48.28 5.5 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.862 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.618 ' HA2' HG12 ' A' ' 89' ' ' VAL . . . 111.8 6.58 24.63 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -176.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.778 HG22 ' H ' ' A' ' 96' ' ' VAL . 2.1 mm -52.18 -177.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.778 ' H ' HG22 ' A' ' 95' ' ' ILE . 2.5 t -138.53 136.11 43.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.265 0.555 . . . . 0.0 111.17 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -151.25 162.29 29.45 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.76 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.468 ' OG1' ' HB2' ' A' ' 101' ' ' ALA . 7.2 p -73.48 148.38 43.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.508 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -47.14 -31.05 3.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.467 -178.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.472 ' N ' ' HG3' ' A' ' 99' ' ' ARG . 26.6 mt-10 -85.95 -38.82 17.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.468 ' HB2' ' OG1' ' A' ' 98' ' ' THR . . . -59.94 -23.76 63.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.708 ' CE2' ' HB3' ' A' ' 88' ' ' ALA . 6.9 m-85 -72.72 161.18 31.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.075 0.464 . . . . 0.0 111.822 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.547 ' CE2' HG23 ' A' ' 112' ' ' VAL . 6.4 t80 -58.44 102.21 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.211 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' NZ ' ' A' ' 107' ' ' LYS . 77.3 p -38.99 -29.48 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.447 -0.797 . . . . 0.0 113.085 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 103' ' ' PHE . 21.9 tttt -50.04 -60.7 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 2.0 p -128.21 -24.44 3.13 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 102' ' ' PHE . 0.0 OUTLIER 70.19 21.58 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.678 0.275 . . . . 0.0 111.06 -179.473 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -110.46 -9.44 14.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.56 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.436 ' CD1' ' CB ' ' A' ' 115' ' ' SER . 35.5 m-85 -128.93 151.39 49.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.745 0.307 . . . . 0.0 110.854 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 4.0 p -61.26 -27.16 68.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 p -160.48 157.6 27.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.968 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.547 HG23 ' CE2' ' A' ' 103' ' ' PHE . 10.9 p -53.18 -31.49 17.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.014 0.435 . . . . 0.0 110.332 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.433 ' O ' ' HG2' ' A' ' 116' ' ' ARG . 25.0 p -68.03 -47.79 67.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.44 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.58 -43.4 84.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.927 0.394 . . . . 0.0 110.254 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.436 ' CB ' ' CD1' ' A' ' 109' ' ' PHE . 47.1 p -57.25 -61.12 2.69 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.594 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 113' ' ' SER . 10.9 ptm180 -54.39 -25.74 26.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.108 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.31 -61.92 1.62 Allowed 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.277 179.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.536 ' HD1' ' O ' ' A' ' 118' ' ' TYR . 0.9 OUTLIER -46.26 -43.94 15.99 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.094 0.473 . . . . 0.0 111.61 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.3 t -69.51 -53.73 17.68 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.693 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 70.7 m -69.07 0.16 5.0 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -91.33 -10.57 40.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.644 0.259 . . . . 0.0 111.103 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 73.88 84.28 0.11 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.855 0.359 . . . . 0.0 111.011 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -82.39 -80.73 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.817 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 tttt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.9 -179.896 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -111.65 -2.95 15.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.588 0.232 . . . . 0.0 111.402 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -122.69 131.92 8.49 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.558 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.4 m 40.78 94.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.791 0.329 . . . . 0.0 111.821 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 6.3 mm-40 -98.93 116.82 65.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.671 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 86' ' ' GLU . 17.2 Cg_exo -66.36 160.22 46.44 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.401 2.067 . . . . 0.0 112.423 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.793 ' O ' HG13 ' A' ' 96' ' ' VAL . . . -136.47 141.45 43.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.216 179.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.449 ' HA ' HG22 ' A' ' 96' ' ' VAL . 21.4 t -110.46 126.38 67.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.848 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 50.5 t -86.57 85.52 7.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.369 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.453 ' HB3' ' CE1' ' A' ' 118' ' ' TYR . 6.7 mm-40 -46.21 -20.69 0.11 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -178.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.488 ' HB2' ' HB2' ' A' ' 118' ' ' TYR . 0.4 OUTLIER -82.95 -58.7 2.75 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.004 0.431 . . . . 0.0 111.325 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.439 ' HB2' HD12 ' A' ' 95' ' ' ILE . 34.0 m -88.99 -56.93 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.09 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 126.89 -10.37 7.06 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 93' ' ' CYS . 3.9 mt -52.2 155.37 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.14 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 88' ' ' ALA . 46.4 t -147.58 125.16 3.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.856 0.36 . . . . 0.0 111.67 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -145.04 -167.8 12.45 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.92 128.46 36.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.48 0.64 . . . . 0.0 111.072 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 101' ' ' ALA . 5.7 mtt180 -33.8 -66.12 0.17 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.311 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -47.31 -6.89 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -178.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' ARG . . . -94.96 -50.32 5.16 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.81 179.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -51.46 172.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.447 ' CE1' ' HB2' ' A' ' 105' ' ' LYS . 2.0 t80 -55.01 110.16 0.63 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.921 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.6 p -68.45 -24.84 64.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.4 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 103' ' ' PHE . 4.5 mttt -55.58 -55.44 31.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.255 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.7 -37.43 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.107 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 70.29 10.77 7.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.343 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.401 ' O ' ' CD1' ' A' ' 109' ' ' PHE . 37.3 mtm180 -113.48 -3.62 13.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.452 ' CE1' ' HD1' ' A' ' 118' ' ' TYR . 40.6 m-85 -147.33 161.77 40.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.226 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 7.1 p -85.5 24.33 1.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.8 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 112' ' ' VAL . 0.0 OUTLIER 174.15 -175.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.574 0.702 . . . . 0.0 112.409 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 113' ' ' SER . 7.1 p -91.24 -54.51 7.34 Favored 'Isoleucine or valine' 0 C--O 1.25 1.104 0 CA-C-N 114.7 -1.136 . . . . 0.0 109.953 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.56 ' N ' HG13 ' A' ' 112' ' ' VAL . 3.9 p -66.32 -27.41 67.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.493 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 14.2 t -63.47 -37.81 88.72 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.769 178.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 109' ' ' PHE . 13.3 t -67.83 -67.19 0.48 Allowed 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -21.1 12.2 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.545 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 113' ' ' SER . 4.2 m -73.54 -58.33 3.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 92' ' ' MET . 8.4 t80 -48.22 -35.22 11.48 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.4 t -84.45 -62.65 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.421 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.4 m -58.43 -54.98 40.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.56 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -86.53 -52.82 5.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.08 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.1 p 56.77 53.5 8.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.975 0.417 . . . . 0.0 110.617 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.75 -168.04 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.702 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.3 mttt . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.939 179.845 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_