data_1e91_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 1e91 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.796 0.332 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.485 HD13 ' CD2' ' B' ' 11' ' ' TYR . 42.2 mm -54.65 -43.31 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.3 m -58.45 -36.37 73.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.872 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.596 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.5 t80 -63.72 -53.73 46.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.935 0.398 . . . . 0.0 110.684 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.435 ' HB ' HD13 ' B' ' 12' ' ' LEU . 33.7 t -61.36 -42.49 93.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.351 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -58.46 -57.46 12.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB2' ' HZ3' ' A' ' 16' ' ' LYS . 5.0 ttmp? -52.99 -40.03 63.5 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.504 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.9 mt -61.9 -40.96 89.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -65.23 -55.33 19.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.273 0.558 . . . . 0.0 110.689 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -60.41 -30.88 69.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.296 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -65.95 -56.38 11.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.205 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.51 ' CD2' HG13 ' A' ' 27' ' ' ILE . 54.2 m-85 -93.29 40.16 1.06 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.14 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 19' ' ' THR . 57.5 mt -55.35 -35.03 64.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.874 0.369 . . . . 0.0 110.63 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -75.43 -39.12 59.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.735 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.56 78.53 0.45 Allowed Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.244 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -60.25 -34.72 93.64 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.712 2.275 . . . . 0.0 112.388 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -51.01 -30.41 15.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.603 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.51 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -63.94 -45.75 96.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.03 0.443 . . . . 0.0 110.817 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.416 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 43.5 t80 -54.91 -48.0 73.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.868 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.5 mmp_? -54.97 -51.86 64.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.47 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.491 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.3 t -54.53 -56.76 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.996 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HA ' HD13 ' A' ' 34' ' ' ILE . 47.0 t80 -48.78 -50.72 32.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.043 0.449 . . . . 0.0 111.163 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.754 HD23 ' HB2' ' B' ' 9' ' ' ALA . 61.5 mt -60.99 -40.06 92.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.622 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.1 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.643 HG22 ' HB2' ' A' ' 61' ' ' GLU . 83.1 mt -63.87 -60.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -55.89 -38.47 70.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.378 178.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -62.79 -46.62 87.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.869 179.136 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.7 m . . . . . 0 CA--C 1.52 -0.211 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.106 179.507 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 . . . . . 0 N--CA 1.46 0.069 0 CA-C-O 120.714 0.292 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.515 ' O ' HG22 ' A' ' 62' ' ' VAL . 48.6 t -52.9 -42.3 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.721 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.556 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.2 t80 -60.05 -38.86 84.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.642 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -70.94 -50.61 32.71 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.638 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.643 ' HB2' HG22 ' A' ' 34' ' ' ILE . 92.5 mt-10 -57.3 -47.27 81.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.239 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 58' ' ' VAL . 98.3 t -64.55 -41.38 92.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.72 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.77 -40.47 92.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.164 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -60.61 -40.72 92.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.468 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mt -63.94 -63.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.333 0.587 . . . . 0.0 110.769 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.48 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.3 m-30 -75.47 42.23 0.21 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.735 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.404 ' HG2' HH11 ' A' ' 67' ' ' ARG . 12.0 tpt180 -59.13 130.97 49.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.648 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.22 -41.93 2.08 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.188 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.424 ' C ' ' H ' ' A' ' 71' ' ' ASP . 19.7 mt-30 -82.23 53.94 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.981 0.42 . . . . 0.0 110.535 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.673 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.4 mt-10 -63.46 1.7 0.51 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.179 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.424 ' H ' ' C ' ' A' ' 69' ' ' GLN . 55.1 m-20 -61.47 -50.05 74.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.136 0.493 . . . . 0.0 109.874 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.28 -32.69 66.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.892 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.72 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.17 -38.94 68.97 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.259 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 t -56.86 -40.97 77.1 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.571 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -64.2 -50.26 68.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.463 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.596 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 14.7 t80 -58.08 -42.36 85.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.728 -179.945 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 46.9 mm . . . . . 0 N--CA 1.459 -0.017 0 CA-C-O 120.807 0.337 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -55.19 -40.91 71.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -66.22 -46.82 75.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.862 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.433 HD23 ' HD2' ' A' ' 13' ' ' TYR . 70.2 mt -67.41 -48.83 66.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.848 0.356 . . . . 0.0 111.181 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.7 tp -57.11 -45.03 83.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.591 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.74 -37.38 76.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.838 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.04 -41.78 65.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.557 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.754 ' HB2' HD23 ' A' ' 32' ' ' LEU . . . -54.58 -45.39 73.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.29 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -62.58 -39.41 93.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.722 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.485 ' CD2' HD13 ' A' ' 11' ' ' ILE . 45.4 t80 -57.53 -55.01 40.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.411 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.435 HD13 ' HB ' ' A' ' 14' ' ' VAL . 97.5 mt -63.62 -45.27 91.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.92 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.263 0 CA-C-O 120.96 0.41 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.523 ' HA ' ' HB3' ' B' ' 8' ' ' ALA . 38.1 mm -50.58 -45.42 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.964 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 48.3 t -57.74 -38.9 76.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.597 -178.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.9 t80 -61.96 -52.0 65.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.794 HG22 ' HB2' ' B' ' 8' ' ' ALA . 26.4 t -63.05 -36.08 74.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.599 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.427 ' HB2' HD12 ' B' ' 12' ' ' LEU . 17.0 t-20 -66.32 -47.18 74.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.531 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' SER . 24.9 mtpp -61.54 -41.14 96.9 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 13' ' ' TYR . 96.7 mt -59.67 -37.53 71.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.841 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.468 ' O ' HD22 ' A' ' 22' ' ' LEU . 26.0 ttpp -67.27 -49.85 62.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.956 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.531 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.9 t -71.28 -28.16 63.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.91 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -65.33 -59.87 3.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.955 0.407 . . . . 0.0 111.253 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.55 ' CD2' HG13 ' A' ' 27' ' ' ILE . 66.9 m-85 -93.7 41.54 1.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.774 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 19' ' ' THR . 65.6 mt -54.16 -34.99 61.78 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.631 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -75.27 -37.75 60.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.428 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -106.71 78.56 0.57 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.25 -32.95 97.06 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.729 2.286 . . . . 0.0 112.327 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.24 -34.95 34.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.917 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.55 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.6 mm -64.58 -47.75 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.536 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 13.3 t80 -61.51 -59.32 5.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.602 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.456 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 22.4 mmt85 -49.79 -53.66 23.88 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.807 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.527 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.9 p -51.9 -51.54 56.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.075 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.469 ' CD1' HG23 ' A' ' 62' ' ' VAL . 46.0 t80 -51.25 -50.06 59.95 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.076 0.465 . . . . 0.0 110.509 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 47.7 mt -57.36 -41.7 80.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.008 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 50.4 mt-10 -64.61 -30.21 71.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.531 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.716 HD13 HD13 ' A' ' 65' ' ' LEU . 66.6 mt -62.44 -54.55 32.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 120.968 0.413 . . . . 0.0 109.927 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.457 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 63.2 mt -61.7 -39.16 90.5 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -59.78 -42.61 93.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.938 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.6 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.214 179.479 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.462 0.126 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.97 -43.37 47.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.037 0.446 . . . . 0.0 110.219 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.575 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.6 t80 -62.59 -35.17 78.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.502 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.8 m -67.16 -56.53 9.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.065 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.641 ' HB2' HG22 ' A' ' 34' ' ' ILE . 57.2 mm-40 -56.87 -44.49 82.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.417 -179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.469 HG23 ' CD1' ' A' ' 31' ' ' PHE . 98.0 t -64.09 -41.71 93.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.201 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.711 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.57 -43.59 97.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.103 0.478 . . . . 0.0 110.271 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -61.45 -40.2 93.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.617 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.716 HD13 HD13 ' A' ' 34' ' ' ILE . 2.8 mt -62.87 -63.83 1.1 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.45 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.468 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.1 m-30 -75.28 42.25 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.66 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -61.5 133.46 55.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 0.0 110.226 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.47 -45.58 3.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.776 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.7 OUTLIER -84.15 49.78 1.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.806 0.336 . . . . 0.0 110.318 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.609 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.7 mt-10 -65.19 6.32 0.28 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.638 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.9 p30 -66.88 -45.51 77.84 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.638 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 60.3 mt -72.72 -34.98 67.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.747 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.711 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -51.45 -43.88 62.21 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.223 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -55.88 -41.04 73.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.931 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -64.35 -45.51 87.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.698 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.607 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.0 t80 -57.96 -43.8 86.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.885 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.556 -179.596 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 48.5 mm . . . . . 0 CA--C 1.526 0.032 0 CA-C-O 120.772 0.32 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' B' ' 3' ' ' GLN . 0.0 OUTLIER -61.02 -48.64 80.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.876 -179.526 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' MET . . . . . 0.406 ' HE1' ' HB3' ' B' ' 4' ' ' MET . 23.6 ptp -73.12 -40.82 64.61 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.148 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.44 ' HA ' HD11 ' B' ' 5' ' ' LEU . 26.7 tp -60.87 -50.73 72.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.032 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 34.5 tp -63.18 -40.81 98.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.149 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -60.6 -34.36 74.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.991 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.794 ' HB2' HG22 ' A' ' 14' ' ' VAL . . . -56.53 -42.29 78.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.141 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.72 87.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.05 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -61.01 -42.81 99.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.454 ' CD2' HD13 ' A' ' 11' ' ' ILE . 39.8 t80 -61.28 -55.38 32.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.176 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.427 HD12 ' HB2' ' A' ' 15' ' ' ASN . 89.6 mt -60.81 -35.21 75.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.015 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.977 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 39.1 mm -60.77 -44.7 97.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.501 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 t -59.43 -42.29 91.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.546 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 12.6 t80 -59.37 -51.78 68.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.911 0.386 . . . . 0.0 110.501 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.532 HG13 HD13 ' B' ' 12' ' ' LEU . 47.7 t -57.33 -44.12 83.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -59.2 -58.27 9.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.173 0.511 . . . . 0.0 110.882 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.664 ' HA ' HG23 ' A' ' 19' ' ' THR . 40.7 ttmt -53.45 -38.95 64.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.715 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 13' ' ' TYR . 71.0 mt -61.77 -40.84 88.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.068 0.461 . . . . 0.0 110.149 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.699 ' HZ2' HD11 ' B' ' 12' ' ' LEU . 3.4 ttmp? -65.17 -55.41 18.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.664 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.4 t -61.22 -30.29 70.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.79 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.453 ' N ' HG21 ' A' ' 19' ' ' THR . 26.8 tpt180 -63.75 -57.61 9.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.236 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.518 ' CD2' HG13 ' A' ' 27' ' ' ILE . 53.7 m-85 -95.52 43.44 1.09 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.047 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 19' ' ' THR . 66.6 mt -55.58 -35.5 65.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 110.751 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -74.77 -37.2 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.727 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -107.17 77.51 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.517 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.072 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -59.35 -33.72 97.66 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.591 2.194 . . . . 0.0 112.329 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -50.76 -32.28 19.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.044 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.518 HG13 ' CD2' ' A' ' 21' ' ' PHE . 7.8 mm -64.39 -47.8 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.706 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.552 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.2 t80 -59.8 -49.68 76.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.119 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -55.87 -53.2 59.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.589 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -52.88 -47.41 67.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.842 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.505 ' HA ' HD11 ' A' ' 34' ' ' ILE . 41.9 t80 -53.7 -48.57 69.41 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.169 0.509 . . . . 0.0 110.88 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 51.9 mt -59.71 -46.76 88.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.438 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.525 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 44.2 tt0 -58.81 -30.59 67.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 30' ' ' SER . 97.2 mt -62.24 -60.45 2.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.702 ' HB2' HD11 ' B' ' 6' ' ' LEU . 58.6 mt -59.95 -35.84 75.8 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 15.3 m-70 -61.63 -42.98 99.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.943 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.1 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.167 0.508 . . . . 0.0 110.319 179.558 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 . . . . . 0 CA--C 1.527 0.075 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -52.83 -41.14 38.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.724 0.297 . . . . 0.0 110.848 -179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.471 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 21.0 t80 -61.71 -39.13 90.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.401 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 16.4 m -67.59 -50.83 56.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.882 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.647 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 57.8 mm-40 -56.88 -48.68 77.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.484 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.557 HG21 HG23 ' A' ' 34' ' ' ILE . 61.5 t -68.48 -44.99 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.81 0.338 . . . . 0.0 111.586 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.676 ' HB3' HD13 ' A' ' 73' ' ' LEU . . . -61.1 -44.2 97.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.506 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.647 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 1.1 p30 -62.42 -38.96 91.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.109 0.481 . . . . 0.0 110.247 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD13 HD13 ' A' ' 34' ' ' ILE . 3.0 mt -60.05 -63.1 1.42 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.191 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.485 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 9.8 m-30 -74.2 41.19 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.597 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HG2' HH11 ' A' ' 67' ' ' ARG . 53.1 ttt-85 -61.06 131.86 51.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.361 . . . . 0.0 110.531 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -45.35 3.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.562 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.61 53.88 2.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.035 0.445 . . . . 0.0 110.341 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.55 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 95.5 mt-10 -59.97 -5.54 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.023 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -60.85 -45.23 95.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 0.0 110.018 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.98 -36.11 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.985 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.676 HD13 ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -53.41 -44.25 68.59 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.73 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.3 m -53.47 -41.33 66.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.815 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.93 -46.91 70.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.08 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.546 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.9 t80 -57.7 -41.76 82.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.161 0.505 . . . . 0.0 110.021 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.76 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . 0.443 ' HA ' HD11 ' B' ' 2' ' ' ILE . 44.7 mm . . . . . 0 C--O 1.228 -0.074 0 CA-C-O 120.59 0.233 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -41.34 68.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.498 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 64.4 mtt -70.31 -42.54 71.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.212 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.537 HD12 ' HD2' ' A' ' 13' ' ' TYR . 19.6 tp -64.42 -49.08 72.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.824 0.345 . . . . 0.0 110.968 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.702 HD11 ' HB2' ' A' ' 35' ' ' LEU . 30.8 tp -63.45 -43.25 97.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.15 -34.45 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.158 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.465 ' HB3' HG22 ' A' ' 14' ' ' VAL . . . -54.15 -38.97 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.94 -45.22 74.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.002 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -63.72 -39.15 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.59 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -55.83 -54.21 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.506 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.699 HD11 ' HZ2' ' A' ' 18' ' ' LYS . 95.8 mt -63.69 -45.86 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.266 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.861 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.281 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.511 HD13 ' CD2' ' B' ' 11' ' ' TYR . 41.8 mm -54.02 -42.99 57.07 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.817 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 m -54.53 -38.53 66.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.132 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 39.4 t80 -66.86 -57.46 6.96 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.931 0.396 . . . . 0.0 111.019 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.493 HG13 ' HA ' ' B' ' 9' ' ' ALA . 39.5 t -57.19 -43.89 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.269 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.54 -52.39 63.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.993 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.502 ' O ' HG21 ' A' ' 19' ' ' THR . 5.0 ttmp? -53.36 -40.08 64.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.0 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.704 HG12 HD12 ' A' ' 72' ' ' LEU . 91.9 mt -62.31 -38.19 80.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.19 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -68.97 -49.23 59.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.075 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.6 t -69.82 -27.97 65.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.654 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.426 ' N ' HG21 ' A' ' 19' ' ' THR . 10.5 tpt180 -67.73 -58.45 4.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.571 ' HZ ' ' HG3' ' A' ' 69' ' ' GLN . 53.1 m-85 -90.94 38.89 0.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' THR . 72.7 mt -54.24 -34.87 61.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.044 0.449 . . . . 0.0 110.342 179.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.23 -37.22 61.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.42 78.69 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.121 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -59.04 -35.15 98.89 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.84 2.36 . . . . 0.0 112.809 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -50.84 -33.09 22.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.378 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.498 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.4 mm -64.54 -48.35 85.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.117 0.484 . . . . 0.0 111.036 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.53 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.0 t80 -59.27 -49.89 76.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.409 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -58.3 -56.17 25.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.041 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.569 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.7 m -53.44 -49.76 66.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.528 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.421 ' O ' ' HB ' ' A' ' 34' ' ' ILE . 57.5 t80 -52.03 -49.68 62.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.986 0.422 . . . . 0.0 111.068 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 86.6 mt -58.66 -41.73 86.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.475 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.61 -30.25 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.121 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.798 HG22 ' HB2' ' A' ' 61' ' ' GLU . 78.1 mt -62.41 -55.1 26.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.6 ' HB2' HD12 ' B' ' 6' ' ' LEU . 54.2 mt -62.83 -38.62 91.51 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.449 0.643 . . . . 0.0 109.534 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.488 ' HA ' HD23 ' B' ' 6' ' ' LEU . 1.8 m-70 -60.82 -47.23 87.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.221 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.4 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 179.374 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 . . . . . 0 C--O 1.231 0.1 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 62' ' ' VAL . 59.6 t -53.55 -45.79 59.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.822 0.344 . . . . 0.0 110.832 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.576 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.4 t80 -60.23 -34.74 74.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.278 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.4 m -66.93 -58.81 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.048 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.798 ' HB2' HG22 ' A' ' 34' ' ' ILE . 66.7 mm-40 -56.72 -44.32 81.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.396 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.702 HG21 HD11 ' A' ' 34' ' ' ILE . 90.1 t -64.05 -42.17 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.474 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.37 -40.54 94.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.087 0.47 . . . . 0.0 110.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -61.29 -42.66 99.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.698 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.48 HD13 HD13 ' A' ' 34' ' ' ILE . 5.5 mt -67.13 -62.7 1.3 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.316 0.579 . . . . 0.0 110.952 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 3.3 m-30 -73.11 37.47 0.08 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.634 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.435 ' C ' ' H ' ' A' ' 69' ' ' GLN . 41.8 ttm180 -58.48 130.84 48.68 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.36 -31.83 2.1 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.764 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.571 ' HG3' ' HZ ' ' A' ' 21' ' ' PHE . 6.4 mm-40 -78.04 48.76 0.75 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.911 0.386 . . . . 0.0 110.492 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.489 ' OE1' ' HA ' ' A' ' 70' ' ' GLU . 4.9 mm-40 -56.08 -14.49 2.67 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.27 -49.83 75.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.639 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.704 HD12 HG12 ' A' ' 17' ' ' ILE . 88.0 mt -70.0 -34.04 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.234 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 1.3 mm? -58.51 -37.38 75.48 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.8 m -54.71 -39.26 68.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.322 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.51 -45.27 22.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.292 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.606 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.8 t80 -57.23 -43.78 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.134 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.989 -179.424 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 45.9 mm . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.703 0.287 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -54.75 -40.97 69.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.753 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 50.8 ttm -65.4 -45.38 84.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.498 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.66 -50.22 65.76 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 35' ' ' LEU . 38.8 tp -58.02 -41.02 82.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.084 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -66.27 -37.54 85.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.287 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.71 91.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.266 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.493 ' HA ' HG13 ' A' ' 14' ' ' VAL . . . -56.83 -46.84 81.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.119 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.401 ' HA ' ' HG2' ' B' ' 13' ' ' GLU . 8.2 t70 -57.47 -38.58 74.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.268 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.511 ' CD2' HD13 ' A' ' 11' ' ' ILE . 57.1 t80 -60.47 -50.66 72.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.436 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.431 HD22 ' CG2' ' A' ' 11' ' ' ILE . 86.2 mt -63.09 -49.81 73.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.804 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' B' ' 10' ' ' ASP . 16.4 pt-20 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.867 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.474 ' HA ' ' HB3' ' B' ' 8' ' ' ALA . 48.8 mm -51.63 -54.26 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.112 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.6 p -51.03 -33.62 26.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.552 ' O ' HG13 ' A' ' 17' ' ' ILE . 30.9 t80 -63.2 -48.72 77.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.807 HG22 ' HB2' ' B' ' 8' ' ' ALA . 32.3 t -68.3 -40.24 82.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.742 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -62.24 -42.72 99.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.908 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.626 ' HA ' HG23 ' A' ' 19' ' ' THR . 40.2 ttmt -66.24 -39.34 89.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.36 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 13' ' ' TYR . 85.7 mt -60.02 -40.82 84.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.175 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.403 ' HZ2' ' HH ' ' A' ' 28' ' ' TYR . 24.0 ttmm -64.47 -56.77 11.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.6 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.626 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.69 -29.67 70.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.008 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.416 ' N ' HG21 ' A' ' 19' ' ' THR . 27.8 tpt180 -68.09 -59.6 3.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.929 0.395 . . . . 0.0 111.283 -179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.542 ' CD2' HG13 ' A' ' 27' ' ' ILE . 60.3 m-85 -91.75 39.17 1.0 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.09 -37.24 53.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.964 0.411 . . . . 0.0 110.577 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.92 -37.46 58.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -104.16 78.61 0.34 Allowed Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.269 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -59.35 -35.42 96.69 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.87 2.38 . . . . 0.0 112.602 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -51.07 -33.12 24.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.048 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.542 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -64.44 -51.28 70.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.804 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.474 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 49.0 t80 -58.03 -47.73 82.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.629 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.41 ' HG2' HH11 ' A' ' 29' ' ' ARG . 49.7 mmt-85 -55.97 -52.22 64.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.319 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.618 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.0 m -53.69 -52.82 58.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.522 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.43 ' HA ' HD13 ' A' ' 34' ' ' ILE . 54.9 t80 -50.16 -51.67 41.66 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.088 0.47 . . . . 0.0 110.97 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' B' ' 9' ' ' ALA . 74.4 mt -58.17 -44.55 88.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.41 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.463 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 17.6 tp10 -62.13 -29.18 70.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.691 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 30' ' ' SER . 72.2 mt -64.33 -56.75 14.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.021 0.438 . . . . 0.0 109.935 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.631 ' HB2' HD12 ' B' ' 6' ' ' LEU . 56.9 mt -62.71 -40.08 96.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.458 0.647 . . . . 0.0 109.322 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 12.1 m-70 -59.14 -47.5 85.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 76.5 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.738 179.777 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.424 ' O ' ' HB ' ' A' ' 60' ' ' THR . 24.0 tt0 . . . . . 0 C--O 1.231 0.125 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.603 HG12 HG23 ' A' ' 34' ' ' ILE . 61.0 t -53.66 -43.46 54.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.872 0.368 . . . . 0.0 110.358 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.596 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 31.3 t80 -61.74 -33.61 74.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.197 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 45.3 m -68.0 -57.2 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.138 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.508 ' HB2' HG22 ' A' ' 34' ' ' ILE . 92.8 mt-10 -57.32 -43.06 83.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.513 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.16 -41.35 92.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 110.119 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.745 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -60.63 -40.92 93.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -63.28 -37.55 87.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.936 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD21 HG21 ' A' ' 27' ' ' ILE . 5.6 mt -65.63 -65.45 0.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.494 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.665 ' HB2' HD22 ' A' ' 73' ' ' LEU . 8.3 m-30 -76.03 44.9 0.33 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.562 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -62.69 137.23 58.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.66 -43.98 2.87 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.295 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' A' ' 71' ' ' ASP . 16.9 pt20 -96.16 56.45 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.757 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 57.8 mp0 -65.81 8.36 0.19 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.153 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.462 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.3 t70 -61.49 -44.64 96.72 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.25 -38.59 75.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.596 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.745 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -55.19 -39.77 69.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.946 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.7 t -56.13 -40.24 73.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.525 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -68.39 -44.45 75.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.793 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.596 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.0 t80 -56.97 -42.0 79.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.803 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.763 -179.947 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 47.4 mm . . . . . 0 CA--C 1.524 -0.042 0 CA-C-O 120.836 0.35 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -57.51 -45.37 85.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.571 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 77.4 mtp -71.89 -43.61 65.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.722 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.05 -51.33 69.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.825 0.345 . . . . 0.0 110.795 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.631 HD12 ' HB2' ' A' ' 35' ' ' LEU . 29.8 tp -60.76 -38.42 85.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.098 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.85 -35.62 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.807 ' HB2' HG22 ' A' ' 14' ' ' VAL . . . -54.25 -39.61 66.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.317 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.549 ' HB3' HD23 ' A' ' 32' ' ' LEU . . . -54.66 -44.48 73.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -63.6 -39.29 94.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.928 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -57.85 -54.5 46.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.52 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -63.05 -47.38 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.114 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.871 179.96 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.331 0 CA-C-O 120.826 0.346 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.7 mm -52.61 -42.59 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.271 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.1 t -54.96 -38.03 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.107 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.584 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.6 t80 -67.48 -56.91 7.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.408 HG11 ' HE1' ' A' ' 28' ' ' TYR . 44.6 t -57.33 -40.43 74.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.217 0.532 . . . . 0.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.02 -54.97 21.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.053 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HA ' HG23 ' A' ' 19' ' ' THR . 63.4 tttm -53.71 -39.72 65.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.06 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 13' ' ' TYR . 87.2 mt -62.73 -37.57 79.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.822 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -66.12 -47.93 72.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.916 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.534 ' HA ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -70.74 -28.86 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.176 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.511 ' N ' HG21 ' A' ' 19' ' ' THR . 26.4 tpt180 -65.22 -56.7 11.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.3 m-85 -91.89 40.35 1.04 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.604 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 35.7 mt -56.61 -31.88 64.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.934 0.397 . . . . 0.0 110.649 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -74.71 -38.05 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.315 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -106.66 78.92 0.59 Allowed Pre-proline 0 N--CA 1.447 -0.581 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.412 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 20.8 Cg_endo -58.98 -35.02 99.34 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.765 2.31 . . . . 0.0 112.604 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -53.01 -29.66 30.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.186 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.482 HG13 ' CD2' ' A' ' 21' ' ' PHE . 15.5 mm -64.25 -49.31 81.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.37 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.607 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.4 t80 -55.59 -50.83 69.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.847 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.43 -51.03 71.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.477 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.559 ' O ' HG13 ' A' ' 34' ' ' ILE . 48.3 t -52.31 -53.65 41.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.352 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -50.47 -50.36 52.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.254 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 29.4 mt -59.92 -40.55 89.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.4 mm-40 -64.73 -32.7 74.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.193 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.7 HG22 ' HB2' ' A' ' 61' ' ' GLU . 75.9 mt -61.47 -54.17 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 120.867 0.365 . . . . 0.0 110.367 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.618 HD21 HG21 ' B' ' 2' ' ' ILE . 77.5 mt -61.92 -42.3 98.93 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.522 ' HA ' HD23 ' B' ' 6' ' ' LEU . 0.4 OUTLIER -56.56 -46.16 80.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.918 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 95.8 m . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.971 179.847 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 . . . . . 0 N--CA 1.462 0.146 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.524 HG13 ' HZ ' ' A' ' 76' ' ' PHE . 88.2 t -53.04 -44.9 52.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.171 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.593 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 18.0 t80 -61.92 -34.21 75.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.907 0.384 . . . . 0.0 110.688 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.9 m -66.06 -56.68 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.14 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.7 ' HB2' HG22 ' A' ' 34' ' ' ILE . 58.7 mm-40 -58.6 -44.93 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.629 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 58' ' ' VAL . 99.6 t -64.05 -42.47 95.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.736 0.303 . . . . 0.0 110.406 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.55 97.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.226 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -58.63 -41.72 86.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.039 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.61 HD13 HD13 ' A' ' 34' ' ' ILE . 4.8 mt -63.37 -60.18 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.555 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -73.52 39.17 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.957 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 67' ' ' ARG . 52.2 ttp85 -61.63 128.92 38.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.789 0.328 . . . . 0.0 110.42 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.19 -41.78 2.67 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.283 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -83.96 57.87 4.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.93 0.395 . . . . 0.0 110.998 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -63.65 -3.3 2.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.51 -54.98 36.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.925 0.393 . . . . 0.0 110.686 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 49.9 mt -68.62 -42.78 77.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.509 0.671 . . . . 0.0 109.933 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 tp -51.97 -38.14 55.57 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.206 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.3 t -55.73 -42.83 75.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.185 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 46.4 mt-10 -63.98 -45.29 89.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.292 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.593 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.3 t80 -57.54 -44.37 85.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.524 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.785 -179.957 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 35' ' ' LEU . 45.5 mm . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -33.91 77.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.073 0.464 . . . . 0.0 109.779 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.3 ttm -62.62 -49.01 76.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.634 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 79.3 mt -68.9 -46.05 69.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.48 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.522 HD23 ' HA ' ' A' ' 36' ' ' HIS . 45.5 tp -56.22 -39.88 73.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.07 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.62 -39.73 77.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.237 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.71 -39.47 71.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.112 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -46.49 79.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.369 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -60.48 -39.2 86.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.669 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.83 -54.82 42.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.422 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.99 -47.08 78.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.116 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.971 -179.77 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.658 0.266 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 43.5 mm -54.27 -42.04 55.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 CA-C-O 120.964 0.411 . . . . 0.0 110.299 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.1 m -56.75 -38.17 72.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.586 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 15.5 t80 -68.43 -55.31 12.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.948 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.9 -44.24 90.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.126 0.489 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -60.18 -55.39 34.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.813 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.732 ' HZ1' HD22 ' A' ' 72' ' ' LEU . 65.6 tttm -56.42 -40.94 75.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.883 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.3 mt -60.49 -47.77 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.904 0.383 . . . . 0.0 110.64 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.483 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 38.7 ttpt -62.85 -56.68 15.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.751 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.687 HG23 ' HA ' ' A' ' 16' ' ' LYS . 13.0 t -57.29 -29.64 64.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.179 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.481 ' N ' HG21 ' A' ' 19' ' ' THR . 18.2 tpp180 -70.01 -55.65 9.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.768 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.481 ' CD2' HG13 ' A' ' 27' ' ' ILE . 57.2 m-85 -91.19 38.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.904 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' THR . 67.5 mt -52.8 -34.47 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.913 0.387 . . . . 0.0 110.675 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.31 -38.99 60.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -106.27 78.25 0.5 Allowed Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.234 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.98 -34.81 94.8 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.671 2.247 . . . . 0.0 112.458 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.0 -31.26 17.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.022 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.481 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.8 mm -64.33 -47.57 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 18' ' ' LYS . 62.0 t80 -58.51 -45.77 88.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.2 mmt-85 -60.01 -56.51 20.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.611 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.573 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -51.08 -49.14 61.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.988 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.514 ' HA ' HD13 ' A' ' 34' ' ' ILE . 51.8 t80 -51.23 -50.37 59.27 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.703 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 90.1 mt -60.22 -39.75 87.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.681 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.51 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.227 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.812 HG22 ' HB2' ' A' ' 61' ' ' GLU . 85.3 mt -61.47 -56.85 15.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.119 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.7 -38.08 83.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.233 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 1.5 m-70 -62.26 -38.39 89.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.225 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 93.3 m . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.079 0.466 . . . . 0.0 110.648 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 . . . . . 0 N--CA 1.461 0.087 0 CA-C-O 120.685 0.279 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 43.2 t -53.14 -44.05 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.216 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.582 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 35.3 t80 -60.15 -37.09 79.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.1 m -73.29 -48.06 37.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.812 ' HB2' HG22 ' A' ' 34' ' ' ILE . 4.7 mm-40 -56.82 -46.6 81.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.705 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.4 t -64.69 -42.35 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.024 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.723 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -59.29 -41.05 88.05 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 109.959 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -61.36 -40.09 93.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.532 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.27 -63.94 0.96 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.764 ' HB2' HD21 ' A' ' 73' ' ' LEU . 4.5 m-30 -74.85 42.76 0.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.793 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -62.16 137.92 58.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.01 -45.01 2.69 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.016 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.435 ' C ' ' H ' ' A' ' 71' ' ' ASP . 4.8 pt20 -95.56 51.83 1.32 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.143 0.496 . . . . 0.0 110.277 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -66.96 7.32 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.97 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.4 t70 -61.42 -45.09 95.78 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.732 HD22 ' HZ1' ' A' ' 16' ' ' LYS . 41.9 mt -69.12 -36.15 77.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.077 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.764 HD21 ' HB2' ' A' ' 66' ' ' PHE . 0.1 OUTLIER -54.91 -40.27 69.67 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.705 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.8 t -56.04 -40.66 73.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.474 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -66.96 -38.47 86.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.064 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.586 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.4 t80 -57.5 -45.55 84.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.779 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.276 179.783 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mm . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.796 0.332 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -32.06 63.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.363 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.24 -45.75 91.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.086 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.64 -46.21 69.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.058 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.72 -46.27 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -68.08 -37.26 81.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.552 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.14 89.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.607 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.32 -43.16 96.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.395 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.14 -48.34 82.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 110.742 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -61.57 -56.58 18.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.387 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 22.5 tp -56.01 -48.59 75.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.752 -178.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.928 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.912 0.387 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.511 HD13 ' CD2' ' B' ' 11' ' ' TYR . 46.7 mm -54.42 -44.93 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.096 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.9 p -58.5 -33.51 69.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.835 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.578 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 34.1 t80 -63.0 -53.26 56.8 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.678 HG22 ' HB3' ' B' ' 8' ' ' ALA . 45.3 t -63.77 -40.06 87.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.929 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.14 -45.5 93.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.136 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.634 ' HA ' HG23 ' A' ' 19' ' ' THR . 87.2 tttt -65.57 -39.35 91.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.541 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.0 mt -60.93 -41.17 87.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.511 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.47 ' HZ3' ' HB3' ' B' ' 12' ' ' LEU . 40.8 ttmt -65.5 -56.18 13.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.602 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.634 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.7 t -60.08 -29.13 68.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.472 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -66.55 -55.37 15.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.918 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.679 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 51.1 m-85 -97.2 45.73 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.022 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.27 -43.31 64.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.87 0.367 . . . . 0.0 110.933 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.08 -22.03 45.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.624 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.679 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.9 m170 -109.69 72.19 0.58 Allowed Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.482 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -66.05 -34.85 36.3 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.495 2.13 . . . . 0.0 112.379 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -52.28 -34.49 46.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.412 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.59 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.29 -45.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.127 0.489 . . . . 0.0 110.423 -179.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -53.44 -49.45 67.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.327 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -60.09 -54.61 43.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.759 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.501 ' O ' HG13 ' A' ' 34' ' ' ILE . 36.1 t -51.56 -49.94 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.232 -179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -53.52 -50.18 65.98 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.907 0.384 . . . . 0.0 110.94 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 96.0 mt -59.18 -37.3 77.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -62.41 -35.97 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.942 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.666 HG22 ' HB3' ' A' ' 61' ' ' GLU . 56.8 mt -61.69 -56.91 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.142 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.518 HD12 HD11 ' B' ' 5' ' ' LEU . 89.0 mt -57.86 -39.13 77.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.345 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -62.2 -40.05 94.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.872 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.8 m . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 121.228 0.537 . . . . 0.0 110.155 179.35 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.539 HG13 ' HZ ' ' A' ' 76' ' ' PHE . 39.2 t -52.3 -47.38 45.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.689 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.561 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.1 t80 -59.89 -35.34 74.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.5 m -75.35 -52.74 10.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.021 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.666 ' HB3' HG22 ' A' ' 34' ' ' ILE . 4.3 tp10 -57.1 -43.96 82.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.692 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 58' ' ' VAL . 72.9 t -64.87 -45.25 95.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.246 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.08 86.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.21 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.99 -39.91 83.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.196 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.505 HD21 HG21 ' A' ' 27' ' ' ILE . 4.9 mt -69.18 -61.84 1.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.578 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.412 ' CZ ' HG22 ' A' ' 17' ' ' ILE . 4.2 m-30 -73.73 38.38 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.649 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 65' ' ' LEU . 39.9 ttm180 -58.59 133.76 56.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.61 -42.0 3.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.881 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.464 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.5 OUTLIER -77.91 52.3 1.04 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.871 0.367 . . . . 0.0 110.773 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -58.75 -15.26 11.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.65 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.47 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.6 p30 -60.92 -40.12 91.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.581 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.473 HD11 HG12 ' A' ' 17' ' ' ILE . 97.6 mt -72.12 -40.77 67.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.001 0.429 . . . . 0.0 110.364 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -57.47 -33.64 68.19 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.062 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.3 t -58.14 -40.47 81.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.247 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -72.59 -44.73 61.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.522 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.578 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 11.8 t80 -57.23 -40.43 77.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.802 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.079 -179.864 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . 0.463 HG21 ' CD2' ' B' ' 6' ' ' LEU . 50.3 mm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.729 0.3 . . . . 0.0 110.853 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -50.73 -37.53 42.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.604 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 59.6 mtt -58.56 -39.35 80.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.015 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.518 HD11 HD12 ' A' ' 35' ' ' LEU . 20.3 mt -71.7 -46.59 58.27 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.463 ' CD2' HG21 ' B' ' 2' ' ' ILE . 4.1 mm? -57.03 -42.51 80.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.518 0.675 . . . . 0.0 109.406 178.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -69.43 -36.51 76.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.856 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.678 ' HB3' HG22 ' A' ' 14' ' ' VAL . . . -61.32 -44.91 96.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.591 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.452 ' HA ' HG13 ' A' ' 14' ' ' VAL . . . -55.61 -41.73 73.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.876 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.87 -38.82 89.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.661 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.511 ' CD2' HD13 ' A' ' 11' ' ' ILE . 50.4 t80 -56.47 -54.0 50.81 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.972 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.47 ' HB3' ' HZ3' ' A' ' 18' ' ' LYS . 95.9 mt -67.36 -43.48 81.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.539 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.119 179.617 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.5 mm -50.91 -44.25 26.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.614 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 t -53.94 -41.61 67.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.506 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.512 ' O ' HG13 ' A' ' 17' ' ' ILE . 29.2 t80 -65.77 -56.61 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.829 0.347 . . . . 0.0 111.088 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' B' ' 9' ' ' ALA . 48.7 t -58.26 -43.49 86.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.341 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -58.07 -55.4 35.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.885 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.57 ' HA ' HG23 ' A' ' 19' ' ' THR . 87.6 tttt -53.63 -38.97 64.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.4 mt -61.23 -43.14 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.557 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -65.03 -56.46 12.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.751 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.57 HG23 ' HA ' ' A' ' 16' ' ' LYS . 12.2 t -59.53 -31.62 69.57 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.818 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.5 tpt85 -68.78 -56.93 6.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.92 0.391 . . . . 0.0 111.359 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.469 ' CD2' HG13 ' A' ' 27' ' ' ILE . 70.9 m-85 -93.43 38.94 1.05 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.209 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 19' ' ' THR . 75.8 mt -53.94 -35.22 61.5 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 110.837 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -75.13 -38.9 60.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.888 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -106.33 79.82 0.64 Allowed Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.521 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 24.1 Cg_endo -58.84 -37.72 92.32 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.901 2.401 . . . . 0.0 112.651 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -48.58 -33.74 10.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.218 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.469 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.2 mm -64.43 -48.91 83.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.782 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.489 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.0 t80 -57.54 -50.84 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.87 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.521 ' HD3' ' O ' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -56.21 -51.58 67.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.37 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.516 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.5 m -50.27 -50.5 50.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.071 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.449 ' HA ' HD11 ' A' ' 34' ' ' ILE . 57.2 t80 -53.35 -47.03 69.74 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.159 0.504 . . . . 0.0 110.611 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.3 mt -59.91 -42.69 94.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.354 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.532 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -61.55 -31.69 71.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.015 178.75 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 30' ' ' SER . 78.0 mt -60.63 -58.19 8.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.42 . . . . 0.0 109.935 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.585 ' HB2' HD11 ' B' ' 6' ' ' LEU . 89.5 mt -60.33 -38.57 84.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.3 m-70 -58.98 -40.81 85.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.707 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.9 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.075 179.301 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 N--CA 1.463 0.179 0 CA-C-O 120.639 0.257 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.497 HG12 HG23 ' A' ' 34' ' ' ILE . 61.1 t -53.35 -41.43 44.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.744 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 16.7 t80 -60.83 -39.13 87.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.8 m -70.94 -47.92 56.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.719 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 5.1 mm-40 -57.7 -46.96 83.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.41 HG23 ' CE1' ' A' ' 31' ' ' PHE . 68.6 t -64.3 -41.26 91.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.911 0.386 . . . . 0.0 110.0 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.741 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.78 -39.96 93.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.105 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -60.48 -41.19 93.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.217 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.75 -64.27 0.89 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.361 0.601 . . . . 0.0 110.669 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.437 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.6 m-30 -76.31 42.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.138 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -57.86 134.22 56.12 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.452 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.94 -41.44 2.39 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.257 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -79.52 59.95 3.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.901 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.429 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -61.51 -6.05 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.113 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.598 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.0 p30 -61.5 -44.32 97.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.424 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.598 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 98.3 mt -72.62 -40.81 66.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.168 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.741 HD22 ' HA ' ' A' ' 63' ' ' ALA . 1.0 OUTLIER -56.31 -35.83 68.0 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.206 179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 t -58.82 -39.94 82.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.468 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 4.7 mm-40 -70.57 -51.36 28.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.106 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 17.9 t80 -57.53 -39.6 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.133 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 CA-C-N 115.638 -0.71 . . . . 0.0 113.385 -179.384 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 41.2 mm . . . . . 0 CA--C 1.524 -0.05 0 CA-C-O 120.79 0.329 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -54.65 -47.06 74.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.04 179.644 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 61.6 mtt -59.18 -49.5 77.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.981 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.44 -48.06 82.88 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.938 0.399 . . . . 0.0 111.021 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.585 HD11 ' HB2' ' A' ' 35' ' ' LEU . 48.5 tp -61.5 -38.15 86.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 3' ' ' GLN . 4.1 tm-20 -67.18 -39.15 86.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.089 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.58 61.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.786 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 14' ' ' VAL . . . -57.08 -43.28 81.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -62.12 -40.61 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.644 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -59.09 -53.53 57.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.637 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.3 mt -64.62 -49.91 69.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.179 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.829 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 120.842 0.353 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.459 HD13 ' CD2' ' B' ' 11' ' ' TYR . 42.6 mm -54.8 -40.52 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.226 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.0 m -55.13 -39.66 69.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.452 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.579 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.0 t80 -68.73 -55.5 11.15 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.969 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.445 ' HB ' HD13 ' B' ' 12' ' ' LEU . 21.5 t -59.35 -37.26 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.938 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -64.03 -56.53 14.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.71 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.565 ' O ' HG21 ' A' ' 19' ' ' THR . 87.6 tttt -53.74 -40.12 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.504 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.1 mt -62.37 -45.74 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HZ2' HD11 ' B' ' 12' ' ' LEU . 3.6 ttmp? -63.01 -55.87 21.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.565 HG21 ' O ' ' A' ' 16' ' ' LYS . 11.8 t -58.8 -32.59 69.49 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.472 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -68.31 -57.36 6.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.375 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -91.62 37.38 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 43.6 mt -56.54 -33.2 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.847 0.356 . . . . 0.0 110.729 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -74.71 -36.95 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.657 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.37 78.9 0.56 Allowed Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.797 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.44 -37.89 95.96 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.886 2.391 . . . . 0.0 112.677 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.95 -33.43 17.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.295 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.406 ' H ' HG12 ' A' ' 27' ' ' ILE . 5.5 mm -64.49 -53.5 41.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.019 0.438 . . . . 0.0 110.814 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.499 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 45.1 t80 -60.5 -49.44 77.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.934 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 29' ' ' ARG . 50.2 mmt-85 -52.67 -52.68 54.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.182 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.613 ' O ' HG13 ' A' ' 34' ' ' ILE . 61.9 m -53.83 -49.32 68.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.977 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.461 ' O ' ' HB ' ' A' ' 34' ' ' ILE . 62.0 t80 -51.65 -50.29 60.64 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.926 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 36.1 mt -57.82 -44.73 86.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.117 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 95.2 mt-10 -62.68 -30.04 71.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.618 HD13 HD13 ' A' ' 65' ' ' LEU . 76.9 mt -60.95 -56.49 17.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.944 0.402 . . . . 0.0 110.241 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.517 ' HB2' HD11 ' B' ' 6' ' ' LEU . 49.5 mt -64.53 -41.72 96.19 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.621 0.724 . . . . 0.0 109.17 178.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.8 m-70 -55.84 -41.61 74.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.954 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 70.1 m . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.384 179.478 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 tp10 . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.494 0.188 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.567 HG11 HG23 ' A' ' 34' ' ' ILE . 88.8 t -53.4 -42.56 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.061 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.602 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 23.4 t80 -63.6 -38.94 93.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 89.6 m -68.47 -48.72 63.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.838 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -57.28 -45.87 83.65 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.825 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.446 HG21 HG22 ' A' ' 34' ' ' ILE . 64.8 t -64.58 -40.78 90.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.742 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -60.85 -39.89 90.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.039 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -64.44 -41.04 96.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.661 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 34' ' ' ILE . 5.3 mt -64.04 -64.16 0.96 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.268 0.556 . . . . 0.0 111.298 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.57 ' HB2' HD22 ' A' ' 73' ' ' LEU . 6.2 m-30 -74.48 40.25 0.13 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.768 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -59.0 131.57 51.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 110.296 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.23 -43.38 2.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.966 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -86.03 52.62 2.53 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.937 0.399 . . . . 0.0 110.525 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 94.9 mt-10 -64.6 0.88 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.013 -179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -61.49 -47.98 83.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.077 0.465 . . . . 0.0 109.96 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.06 -33.64 68.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.966 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.742 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.74 -43.23 68.93 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.676 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.8 t -54.36 -40.49 68.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.696 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 49.4 mt-10 -63.35 -46.32 87.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.451 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.602 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 13.4 t80 -57.72 -44.68 86.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.54 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.047 -179.826 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 40.2 mm . . . . . 0 C--O 1.227 -0.101 0 CA-C-O 120.449 0.166 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -35.05 62.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.655 0.264 . . . . 0.0 110.61 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 95.8 mmm -69.42 -45.82 68.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.649 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.544 HD12 ' HD2' ' A' ' 13' ' ' TYR . 20.2 tp -64.03 -49.2 73.33 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.936 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 35' ' ' LEU . 28.5 tp -59.86 -40.39 88.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.022 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -63.88 -37.3 86.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' B' ' 5' ' ' LEU . . . -54.6 -41.5 70.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.923 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.22 81.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.72 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -59.03 -38.44 79.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.176 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.459 ' CD2' HD13 ' A' ' 11' ' ' ILE . 66.6 t80 -63.42 -44.47 94.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.671 HD11 ' HZ2' ' A' ' 18' ' ' LYS . 84.6 mt -75.86 24.7 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.715 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.444 ' H ' ' C ' ' B' ' 11' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.183 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.124 0.488 . . . . 0.0 110.318 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 49.4 mm -52.57 -41.89 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.92 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.0 t -58.7 -37.64 76.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.191 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.622 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -63.26 -54.15 41.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.25 0.547 . . . . 0.0 109.741 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' B' ' 9' ' ' ALA . 53.1 t -60.36 -38.94 79.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.85 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.401 ' HB2' HD12 ' B' ' 12' ' ' LEU . 19.2 t-20 -63.6 -47.28 82.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.391 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.623 ' HA ' HG23 ' A' ' 19' ' ' THR . 23.5 ttmm -63.28 -36.14 82.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.563 HG12 HD12 ' A' ' 72' ' ' LEU . 81.2 mt -64.66 -42.55 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.823 0.344 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.459 ' O ' HD22 ' A' ' 22' ' ' LEU . 28.7 mtpp -62.29 -46.6 88.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 110.783 179.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.623 HG23 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -71.27 -29.45 65.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.529 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.433 ' N ' HG21 ' A' ' 19' ' ' THR . 18.9 tpp180 -67.14 -56.02 11.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.278 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CD2' HG13 ' A' ' 27' ' ' ILE . 73.1 m-85 -95.48 42.09 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 19' ' ' THR . 77.9 mt -54.97 -36.6 65.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.331 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -75.66 -38.47 58.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.885 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -105.86 78.15 0.45 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.198 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.45 -33.65 93.8 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.75 2.3 . . . . 0.0 112.518 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -53.51 -30.21 40.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 21' ' ' PHE . 6.9 mm -64.19 -51.95 62.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.837 0.351 . . . . 0.0 111.017 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.507 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 62.7 t80 -57.08 -46.1 82.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.823 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.486 HH11 ' HA ' ' A' ' 29' ' ' ARG . 3.8 mmm180 -55.68 -56.11 24.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.618 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.415 ' HB2' HD12 ' A' ' 65' ' ' LEU . 50.9 m -54.64 -49.88 69.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.21 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.559 ' CZ ' HD13 ' A' ' 35' ' ' LEU . 49.4 t80 -49.15 -47.11 45.98 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.027 0.442 . . . . 0.0 110.825 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 90.0 mt -60.09 -40.69 90.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.555 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -63.4 -36.81 84.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.48 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.488 HG22 HG21 ' A' ' 62' ' ' VAL . 75.3 mt -60.07 -56.32 18.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.749 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.559 HD13 ' CZ ' ' A' ' 31' ' ' PHE . 83.4 mt -59.02 -44.41 91.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.326 0.584 . . . . 0.0 109.468 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.465 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -54.96 -42.68 72.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.708 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.52 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.393 0.14 . . . . 0.0 111.364 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -56.91 -44.14 81.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 0.0 110.375 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.7 t80 -64.24 -37.93 89.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.724 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.9 m -65.47 -55.27 18.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.11 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HB2' HG22 ' A' ' 34' ' ' ILE . 59.3 mm-40 -57.54 -46.5 83.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.488 HG21 HG22 ' A' ' 34' ' ' ILE . 85.8 t -64.0 -41.35 92.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.717 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.9 -41.09 95.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.14 0.495 . . . . 0.0 109.931 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -60.08 -44.56 94.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.553 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' A' ' 67' ' ' ARG . 3.1 mt -63.17 -61.56 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.334 0.588 . . . . 0.0 110.605 179.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -72.94 36.94 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.486 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 65' ' ' LEU . 29.5 tpt85 -59.6 129.46 42.03 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -36.14 2.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.371 -0.918 . . . . 0.0 111.553 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 67' ' ' ARG . 7.9 mm-40 -78.28 42.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.836 0.35 . . . . 0.0 110.17 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.615 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 6.3 tt0 -53.99 -11.68 0.48 Allowed 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -60.69 -49.4 77.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.87 0.367 . . . . 0.0 110.074 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.563 HD12 HG12 ' A' ' 17' ' ' ILE . 82.3 mt -72.49 -34.38 67.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.541 . . . . 0.0 110.058 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.717 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -52.04 -42.32 63.02 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.107 -179.652 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 t -56.87 -41.13 77.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.257 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -67.99 -46.63 70.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.034 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.622 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.4 t80 -58.35 -41.48 84.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.357 0 CA-C-N 115.421 -0.809 . . . . 0.0 114.069 -178.99 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 51.4 mm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.605 0.24 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -33.85 68.31 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.1 mmt -59.15 -39.44 82.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.1 mt -72.14 -45.77 59.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.467 HD23 ' HB3' ' A' ' 35' ' ' LEU . 3.3 mm? -56.8 -42.72 80.01 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.453 0.645 . . . . 0.0 109.265 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.93 -37.19 72.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.154 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.65 -47.19 84.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.03 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.463 ' HA ' HG12 ' A' ' 14' ' ' VAL . . . -55.86 -43.21 76.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.321 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.64 -38.96 89.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.715 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.23 -54.95 33.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.746 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.401 HD12 ' HB2' ' A' ' 15' ' ' ASN . 95.5 mt -62.41 -51.33 67.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.627 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.909 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.25 0 CA-C-O 120.781 0.324 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.437 HD13 ' CD2' ' B' ' 11' ' ' TYR . 40.3 mm -53.35 -45.48 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.261 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -58.29 -35.37 71.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.114 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.623 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 38.7 t80 -63.35 -55.83 21.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.195 0.521 . . . . 0.0 109.815 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.9 t -60.73 -38.02 77.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.453 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.476 ' HB2' HD12 ' B' ' 12' ' ' LEU . 20.8 t-20 -64.57 -41.08 96.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.691 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.63 ' HA ' HG23 ' A' ' 19' ' ' THR . 40.4 ttmt -66.77 -38.72 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.125 0.488 . . . . 0.0 110.121 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.8 mt -62.11 -42.83 96.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.68 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -65.28 -54.78 24.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.641 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.63 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.6 t -59.64 -31.27 69.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.569 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.546 ' N ' HG21 ' A' ' 19' ' ' THR . 17.2 tpp180 -68.11 -52.42 35.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.115 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.599 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 78.2 m-85 -98.3 44.17 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.026 -179.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 85.2 mt -56.39 -42.41 77.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.854 0.359 . . . . 0.0 110.546 179.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -76.21 -23.72 54.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.157 0.503 . . . . 0.0 109.86 179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.599 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.3 m170 -108.99 73.06 0.5 Allowed Pre-proline 0 CA--C 1.535 0.366 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.351 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.39 -34.59 43.2 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.639 2.226 . . . . 0.0 112.46 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -53.91 -35.25 61.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.427 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.566 ' CG1' ' HB3' ' A' ' 24' ' ' HIS . 1.0 OUTLIER -64.29 -51.65 65.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.556 -179.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.554 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 54.9 t80 -56.9 -47.24 81.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.95 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -55.61 -54.6 42.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.277 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 34' ' ' ILE . 44.7 t -54.16 -48.12 71.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.536 ' HA ' HD11 ' A' ' 34' ' ' ILE . 49.0 t80 -52.33 -47.52 65.98 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.99 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.4 mt -60.09 -41.42 92.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.488 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 39.3 tt0 -63.77 -30.02 71.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.693 HG22 ' HB2' ' A' ' 61' ' ' GLU . 79.6 mt -62.47 -56.71 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.124 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.052 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HB2' HD11 ' B' ' 6' ' ' LEU . 78.3 mt -61.82 -36.26 80.64 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.5 0.667 . . . . 0.0 109.232 178.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.488 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 5.1 m-70 -59.95 -48.06 83.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.901 179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.5 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.239 179.121 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 . . . . . 0 N--CA 1.461 0.09 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.689 HG12 HG23 ' A' ' 34' ' ' ILE . 44.6 t -52.94 -43.11 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.639 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.55 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 40.2 t80 -61.15 -36.88 80.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.875 0.369 . . . . 0.0 110.302 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 88.1 m -71.79 -48.39 46.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.475 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.693 ' HB2' HG22 ' A' ' 34' ' ' ILE . 4.8 mm-40 -56.78 -48.07 78.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.932 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.56 -41.85 93.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.068 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.723 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -59.7 -39.03 83.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.85 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -63.91 -37.98 89.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.347 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 34' ' ' ILE . 5.8 mt -70.56 -66.28 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.512 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.543 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.0 m-30 -74.55 38.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.087 -178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -66.4 138.49 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.549 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.31 -44.53 2.79 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.527 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.55 ' C ' ' H ' ' A' ' 71' ' ' ASP . 0.7 OUTLIER -68.47 -62.95 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.82 0.343 . . . . 0.0 110.573 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.6 mt-10 59.98 -15.94 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.55 ' H ' ' C ' ' A' ' 69' ' ' GLN . 34.4 t70 -61.99 -49.17 77.15 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-O 121.096 0.474 . . . . 0.0 109.897 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.3 mt -68.84 -36.35 78.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.834 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.723 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.59 -39.35 67.74 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.68 179.858 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.4 t -55.44 -41.96 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.738 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.66 -42.77 77.44 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.539 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.623 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 20.1 t80 -57.28 -44.22 83.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.846 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.59 -179.969 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . 0.447 ' HA ' ' HB3' ' B' ' 5' ' ' LEU . 48.1 mm . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 120.649 0.262 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -55.4 -58.13 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.485 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -79.77 -27.99 40.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.455 HD11 HD12 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -58.87 -45.95 88.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.845 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.599 HD11 ' HB2' ' A' ' 35' ' ' LEU . 43.1 tp -77.77 -44.46 27.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 tp10 -56.52 -33.16 65.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.653 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.95 82.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.357 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' B' ' 13' ' ' GLU . . . -56.47 -47.68 78.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.442 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.98 -38.88 83.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.437 ' CD2' HD13 ' A' ' 11' ' ' ILE . 47.2 t80 -59.53 -54.77 42.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.849 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.476 HD12 ' HB2' ' A' ' 15' ' ' ASN . 89.0 mt -60.87 -48.83 80.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.903 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 12.5 pt-20 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.332 0 CA-C-O 120.925 0.393 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.429 HD13 ' CD2' ' B' ' 11' ' ' TYR . 42.4 mm -53.79 -42.76 53.7 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.416 179.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 m -55.58 -37.97 68.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.823 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.556 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.9 t80 -64.84 -58.08 7.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.847 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.88 -45.09 91.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.396 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -61.07 -54.58 42.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.042 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.608 ' O ' HG21 ' A' ' 19' ' ' THR . 87.8 tttt -53.64 -37.42 63.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.197 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 13' ' ' TYR . 95.5 mt -64.84 -37.26 79.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.002 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -65.54 -47.59 75.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.426 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.3 t -70.98 -26.99 63.39 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.754 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.462 ' HG2' HD13 ' A' ' 72' ' ' LEU . 19.5 tpp180 -64.77 -58.07 7.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.318 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.773 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 61.6 m-85 -94.89 46.42 1.13 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.427 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.5 mt -55.45 -40.74 71.96 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.811 0.338 . . . . 0.0 110.796 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.38 -19.35 46.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.094 0.473 . . . . 0.0 110.156 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.773 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 58.1 m170 -110.33 74.06 0.82 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.354 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.72 -35.61 56.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.589 2.193 . . . . 0.0 112.55 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -52.17 -36.47 51.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.63 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.46 -48.35 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 110.701 -179.738 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.61 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 55.3 t80 -56.92 -51.36 69.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.118 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.413 ' HG3' HH11 ' A' ' 29' ' ' ARG . 21.5 mmt85 -56.9 -54.29 48.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.493 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.584 ' O ' HG13 ' A' ' 34' ' ' ILE . 57.0 m -52.85 -49.56 65.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.626 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.701 ' HA ' HD13 ' A' ' 34' ' ' ILE . 51.9 t80 -53.54 -49.81 66.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 110.959 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 41.2 mt -58.1 -39.78 79.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.161 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.59 -29.53 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.201 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.701 HD13 ' HA ' ' A' ' 31' ' ' PHE . 82.9 mt -61.75 -59.53 4.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.57 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 86.3 mt -60.3 -38.79 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.535 ' HA ' HD23 ' B' ' 6' ' ' LEU . 1.1 m-70 -59.74 -42.79 93.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.242 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.3 m . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.371 179.295 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.8 t -52.63 -40.68 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.396 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.485 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 22.5 t80 -60.38 -40.22 90.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.561 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.3 m -73.59 -44.8 56.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.407 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.644 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -57.29 -47.77 80.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.232 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.476 HG21 HG23 ' A' ' 34' ' ' ILE . 61.5 t -71.66 -42.93 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.744 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -62.21 -44.81 95.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.134 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.644 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -64.12 -40.87 97.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.87 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.401 ' C ' ' H ' ' A' ' 67' ' ' ARG . 3.2 mt -60.98 -61.0 2.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.829 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.449 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 6.6 m-30 -72.95 38.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.826 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 65' ' ' LEU . 46.2 ttm-85 -60.2 127.88 34.01 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.49 -43.23 2.78 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.802 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.43 49.84 1.88 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.94 0.4 . . . . 0.0 110.453 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.8 mt-10 -60.63 -8.52 2.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.732 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -61.16 -45.68 93.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.93 0.395 . . . . 0.0 109.942 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.462 HD13 ' HG2' ' A' ' 20' ' ' ARG . 94.4 mt -72.15 -32.63 67.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.919 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.744 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.28 -42.53 73.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.738 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 44.3 t -53.79 -39.94 65.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.234 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -68.0 -41.53 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.608 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.556 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 12.4 t80 -56.54 -43.55 79.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.246 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.26 179.553 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . 0.4 HG21 HD23 ' A' ' 35' ' ' LEU . 37.7 mm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.857 0.361 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.64 -35.13 40.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.233 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 24.9 mmt -63.14 -50.39 70.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.591 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.484 HD23 ' HD2' ' A' ' 13' ' ' TYR . 81.9 mt -65.95 -46.91 76.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 41.4 tp -61.17 -47.22 87.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.27 -35.51 80.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.418 . . . . 0.0 110.184 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.57 62.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.917 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -48.27 79.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.134 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.6 -38.73 91.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.629 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.429 ' CD2' HD13 ' A' ' 11' ' ' ILE . 50.6 t80 -57.94 -54.24 49.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.351 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.432 ' HA ' HD21 ' B' ' 12' ' ' LEU . 96.0 mt -64.55 -49.55 70.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.221 -179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.889 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.6 mm -53.15 -43.06 48.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.046 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -57.15 -38.47 73.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.028 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.573 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 25.1 t80 -63.88 -55.97 18.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.088 0.47 . . . . 0.0 110.768 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.9 t -57.1 -45.0 84.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.378 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -57.69 -56.32 23.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.111 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.629 ' HA ' HG23 ' A' ' 19' ' ' THR . 88.2 tttt -52.99 -36.53 60.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.518 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.9 mt -64.19 -41.12 91.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.268 179.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -64.17 -55.48 21.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.507 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.629 HG23 ' HA ' ' A' ' 16' ' ' LYS . 13.3 t -59.22 -31.18 68.81 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.396 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.507 ' N ' HG21 ' A' ' 19' ' ' THR . 10.8 tpt180 -68.11 -56.09 10.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.909 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CE2' HG22 ' A' ' 27' ' ' ILE . 55.8 m-85 -93.98 41.31 1.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.989 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.0 mt -56.96 -35.36 69.03 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.996 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -74.95 -39.95 61.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.021 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -107.74 77.24 0.61 Allowed Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.356 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.99 -33.74 95.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.593 2.195 . . . . 0.0 112.395 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -51.2 -34.11 30.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.595 HG21 HD21 ' A' ' 65' ' ' LEU . 3.8 mm -64.37 -45.99 94.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.167 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.581 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 59.8 t80 -58.82 -49.39 77.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -56.24 -55.49 32.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.466 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.629 ' HG ' HD23 ' A' ' 65' ' ' LEU . 18.5 p -53.02 -49.01 67.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.325 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.649 ' HA ' HD13 ' A' ' 34' ' ' ILE . 47.8 t80 -51.2 -45.25 61.78 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.878 0.37 . . . . 0.0 110.435 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 64.9 mt -62.93 -49.51 74.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -53.65 -29.39 38.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.481 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.649 HD13 ' HA ' ' A' ' 31' ' ' PHE . 84.3 mt -61.26 -49.62 83.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.104 0.478 . . . . 0.0 110.135 179.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.15 -40.97 90.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -38.86 84.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.21 178.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.621 178.921 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.595 0.236 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 66.9 t -57.96 -43.15 84.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.984 0.421 . . . . 0.0 110.513 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.624 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.3 t80 -62.86 -39.44 94.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.944 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -66.14 -49.67 66.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.628 ' HB2' HG22 ' A' ' 34' ' ' ILE . 62.6 mm-40 -57.33 -45.29 84.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.016 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.7 t -64.48 -40.83 90.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.054 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.743 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.89 -41.66 98.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.098 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -62.01 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.532 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.629 HD23 ' HG ' ' A' ' 30' ' ' SER . 5.8 mt -67.64 -65.06 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.431 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.507 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 5.9 m-30 -73.43 38.86 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.638 -179.071 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 65' ' ' LEU . 12.1 tpt180 -58.76 132.62 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.23 -43.32 3.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.791 -178.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.8 OUTLIER -79.93 51.23 1.3 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.81 0.338 . . . . 0.0 110.587 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.1 mt-10 -61.72 -4.33 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.051 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.72 -50.61 71.75 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.964 0.411 . . . . 0.0 110.066 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.58 -36.28 73.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.981 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.743 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.92 -40.85 70.29 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.64 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.9 t -56.3 -40.35 74.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.562 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.29 -38.91 71.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.088 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.624 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.6 t80 -57.51 -43.24 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.005 0.431 . . . . 0.0 110.233 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.364 179.647 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 40.6 mm . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.721 0.296 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . 0.411 HE21 ' HB2' ' B' ' 3' ' ' GLN . 0.0 OUTLIER -55.41 -34.34 64.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.511 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 45.8 ttm -63.26 -49.92 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.256 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 68.6 mt -68.46 -46.72 69.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.955 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.0 tp -56.85 -44.46 82.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -68.27 -39.58 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.615 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.49 79.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.15 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.9 -40.65 96.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.279 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -64.01 -44.22 93.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.793 0.33 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -64.05 -58.67 5.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.473 0.654 . . . . 0.0 110.776 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 21.2 tp -57.95 -36.97 73.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.43 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.922 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.308 0 CA-C-O 120.846 0.355 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.496 HD13 ' CD2' ' B' ' 11' ' ' TYR . 47.0 mm -51.75 -47.15 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.373 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -55.54 -36.61 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.183 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.571 ' O ' HG13 ' A' ' 17' ' ' ILE . 26.5 t80 -62.46 -54.27 42.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.191 0.519 . . . . 0.0 109.68 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' B' ' 9' ' ' ALA . 61.2 t -57.75 -40.12 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.542 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.64 -53.03 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.437 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.617 ' HA ' HG23 ' A' ' 19' ' ' THR . 61.3 tttp -58.14 -36.72 73.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.937 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 13' ' ' TYR . 89.1 mt -61.43 -38.47 80.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.987 0.422 . . . . 0.0 110.286 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 29.6 mtpp -64.55 -45.22 88.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.255 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.617 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.7 t -74.83 -28.66 60.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.909 -179.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.426 ' N ' HG21 ' A' ' 19' ' ' THR . 26.6 tpt180 -63.51 -56.47 15.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.974 0.416 . . . . 0.0 111.143 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.652 ' CD2' HG13 ' A' ' 27' ' ' ILE . 50.6 m-85 -97.11 48.21 1.05 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.3 mt -52.71 -40.46 63.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.692 0.282 . . . . 0.0 111.111 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -77.31 -27.32 52.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.189 0.519 . . . . 0.0 110.036 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 63.6 m170 -109.76 73.41 0.66 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.735 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -65.82 -32.71 45.62 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.311 2.007 . . . . 0.0 112.126 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -54.91 -32.09 60.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.512 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.652 HG13 ' CD2' ' A' ' 21' ' ' PHE . 2.4 mm -63.81 -48.53 85.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.958 0.409 . . . . 0.0 110.345 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.558 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.8 t80 -56.81 -48.98 76.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.532 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -56.95 -54.9 41.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.452 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.558 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.9 m -53.05 -46.43 68.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.934 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.543 ' HA ' HD13 ' A' ' 34' ' ' ILE . 43.7 t80 -52.63 -48.07 66.63 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.002 0.429 . . . . 0.0 110.699 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.647 HD23 ' HB3' ' B' ' 9' ' ' ALA . 48.9 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.284 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.534 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.0 mm-40 -61.68 -31.79 71.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.18 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 30' ' ' SER . 68.0 mt -62.23 -55.81 21.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.429 . . . . 0.0 109.898 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.58 -39.69 88.96 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.56 ' HA ' HD23 ' B' ' 6' ' ' LEU . 9.7 m-70 -58.07 -42.83 86.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.596 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.4 m . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.307 179.306 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.486 ' O ' ' HB ' ' A' ' 60' ' ' THR . 29.9 tt0 . . . . . 0 N--CA 1.46 0.048 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 97.5 t -53.38 -44.78 55.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.98 0.419 . . . . 0.0 110.294 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.608 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.5 t80 -61.34 -30.75 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.271 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.486 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 58.5 m -66.76 -62.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.399 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.505 ' HB2' HG22 ' A' ' 34' ' ' ILE . 8.8 mp0 -57.06 -41.46 78.77 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.65 -44.34 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.729 0.3 . . . . 0.0 110.428 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.713 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.29 -41.67 97.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 0.0 109.986 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -62.31 -41.96 98.97 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.844 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.509 HD21 HG21 ' A' ' 27' ' ' ILE . 4.7 mt -63.51 -64.05 1.01 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.412 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.483 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.3 m-30 -73.61 38.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.613 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.406 ' H ' ' C ' ' A' ' 65' ' ' LEU . 30.8 tpt180 -62.72 130.68 46.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.825 0.345 . . . . 0.0 110.201 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.07 -44.3 3.11 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.72 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.469 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.54 54.8 3.29 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.038 0.447 . . . . 0.0 110.309 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 70' ' ' GLU . 4.8 mm-40 -60.73 -3.76 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.493 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.1 -50.29 73.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.909 0.385 . . . . 0.0 110.587 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.446 HD13 ' HE1' ' A' ' 21' ' ' PHE . 85.9 mt -68.02 -36.1 79.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.21 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.713 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.37 -37.71 65.29 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.74 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.0 t -56.74 -42.28 79.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.47 -41.08 76.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.608 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.9 t80 -57.0 -43.25 81.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.338 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.948 -179.958 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 40.1 mm . . . . . 0 N--CA 1.458 -0.046 0 CA-C-O 120.548 0.213 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.92 -39.3 39.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.318 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 56.7 mtm -71.14 -42.62 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.059 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.43 ' HA ' HD11 ' B' ' 5' ' ' LEU . 22.6 tp -65.33 -53.11 48.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.403 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.56 HD23 ' HA ' ' A' ' 36' ' ' HIS . 34.7 tp -57.85 -39.3 77.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 109.911 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -66.02 -36.64 83.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.401 ' O ' ' HB3' ' B' ' 11' ' ' TYR . . . -57.44 -42.47 82.51 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.172 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.647 ' HB3' HD23 ' A' ' 32' ' ' LEU . . . -55.99 -45.85 78.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.995 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -59.46 -38.3 80.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.306 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.496 ' CD2' HD13 ' A' ' 11' ' ' ILE . 45.6 t80 -58.93 -54.99 40.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.306 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.86 -43.46 98.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.143 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' B' ' 9' ' ' ALA . 56.1 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.94 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.824 0.345 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.0 mm -51.93 -45.52 40.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.095 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.562 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 92.9 p -56.97 -38.7 73.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.164 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.619 ' HH ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 t80 -62.77 -54.8 33.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.961 0.41 . . . . 0.0 110.665 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.94 -39.85 68.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.99 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -58.44 -55.47 34.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.539 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.64 ' HA ' HG23 ' A' ' 19' ' ' THR . 27.2 mtpp -53.03 -37.67 61.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.2 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' HD1' ' A' ' 21' ' ' PHE . 80.0 mt -62.02 -40.23 86.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.139 0.495 . . . . 0.0 110.231 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.458 ' NZ ' ' HB3' ' B' ' 12' ' ' LEU . 41.3 ttmt -66.73 -54.0 27.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.902 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.64 HG23 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -62.91 -32.27 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.87 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.542 ' N ' HG21 ' A' ' 19' ' ' THR . 12.2 tpp85 -69.24 -49.15 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.072 0.463 . . . . 0.0 110.924 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.516 ' CE2' HG22 ' A' ' 27' ' ' ILE . 17.8 m-85 -92.64 40.86 1.06 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.816 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 19' ' ' THR . 38.3 mt -61.56 -35.87 79.01 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.04 -37.97 61.56 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.976 0.417 . . . . 0.0 110.482 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.502 ' HB2' ' CG1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -115.44 74.57 4.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.065 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.29 -29.78 80.42 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.575 2.183 . . . . 0.0 111.908 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -52.03 -30.98 27.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.813 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.55 HG21 HD21 ' A' ' 65' ' ' LEU . 1.6 mm -63.77 -39.55 85.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.301 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.58 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 68.2 t80 -56.44 -48.14 77.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.56 HH11 ' HA ' ' A' ' 29' ' ' ARG . 4.2 mmm180 -56.51 -57.41 12.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.799 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.656 ' HG ' HD12 ' A' ' 65' ' ' LEU . 32.5 p -48.82 -48.73 41.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.662 ' HA ' HD13 ' A' ' 34' ' ' ILE . 51.7 t80 -51.7 -47.41 63.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.071 0.462 . . . . 0.0 110.637 178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' B' ' 9' ' ' ALA . 49.2 mt -58.61 -40.95 84.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.139 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 57.6 mm-40 -63.24 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.051 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.775 HG23 HG21 ' A' ' 62' ' ' VAL . 53.1 mt -62.9 -56.85 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-O 120.96 0.41 . . . . 0.0 110.244 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.81 -37.3 78.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 5.3 m-70 -62.29 -41.62 98.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.573 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m . . . . . 0 CA--C 1.52 -0.194 0 CA-C-O 121.194 0.521 . . . . 0.0 109.853 179.109 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 . . . . . 0 N--CA 1.462 0.132 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 46.8 t -52.73 -44.12 46.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.165 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.572 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.2 t80 -62.41 -36.01 81.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -72.07 -50.97 23.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.937 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.616 ' HG3' HD12 ' A' ' 34' ' ' ILE . 4.6 tp10 -58.44 -45.79 87.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.01 -179.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.775 HG21 HG23 ' A' ' 34' ' ' ILE . 94.3 t -64.45 -43.03 96.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.45 -42.18 95.62 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.15 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -59.2 -39.73 83.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.321 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.656 HD12 ' HG ' ' A' ' 30' ' ' SER . 6.5 mt -68.49 -64.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.286 179.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.519 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 3.7 m-30 -74.18 41.65 0.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.65 -178.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -62.18 137.55 58.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.867 0.365 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.09 -45.01 3.25 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.323 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' A' ' 71' ' ' ASP . 17.7 mt-30 -88.02 52.88 2.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.064 0.459 . . . . 0.0 110.491 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.6 mt-10 -67.75 6.23 0.7 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.266 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 69' ' ' GLN . 55.0 m-20 -61.64 -48.98 78.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.174 0.511 . . . . 0.0 110.056 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.4 mt -72.32 -34.3 67.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.222 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -53.98 -38.16 64.73 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.993 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -55.11 -42.61 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.741 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.55 -45.84 78.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.592 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.619 ' HB2' ' HH ' ' A' ' 13' ' ' TYR . 22.7 t80 -57.54 -44.13 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.421 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.266 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.709 -179.212 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 46.2 mm . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.599 0.238 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -35.98 55.23 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 66.1 mtt -65.15 -47.33 77.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.528 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.473 HD23 ' HD2' ' A' ' 13' ' ' TYR . 80.2 mt -69.78 -45.7 67.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.959 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 56.0 tp -57.41 -44.35 84.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -72.53 -38.48 68.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.786 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.45 -41.77 77.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.209 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.581 ' HB3' HD23 ' A' ' 32' ' ' LEU . . . -55.05 -43.24 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.971 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.67 -38.04 89.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.428 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -57.13 -55.44 34.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.059 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.458 ' HB3' ' NZ ' ' A' ' 18' ' ' LYS . 95.9 mt -64.42 -49.29 72.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.526 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.196 179.683 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.932 0.396 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 32.6 mm -52.94 -45.3 51.45 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.081 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -57.44 -36.25 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.191 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.52 ' O ' HG13 ' A' ' 17' ' ' ILE . 10.1 t80 -65.97 -53.16 42.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.651 HG13 HD13 ' B' ' 12' ' ' LEU . 46.2 t -59.04 -44.24 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.499 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.78 -59.9 4.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.197 0.522 . . . . 0.0 111.198 -179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.596 ' HA ' HG23 ' A' ' 19' ' ' THR . 88.3 tttt -53.48 -38.63 63.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.711 -179.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.2 mt -62.37 -40.6 88.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.965 0.412 . . . . 0.0 110.214 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -63.91 -58.27 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.596 HG23 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -58.16 -31.45 67.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.475 -179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.533 ' N ' HG21 ' A' ' 19' ' ' THR . 33.7 tpt85 -64.74 -57.59 8.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.383 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.503 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.0 m-85 -92.98 40.66 1.06 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.392 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 19' ' ' THR . 62.9 mt -54.59 -34.77 62.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -75.26 -39.22 60.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -105.72 78.87 0.48 Allowed Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.401 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.428 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 21.4 Cg_endo -59.26 -35.3 97.48 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.726 2.284 . . . . 0.0 112.46 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -50.8 -31.42 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.422 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.4 mm -64.27 -46.77 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 0.0 110.646 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.544 ' CE2' HD13 ' A' ' 32' ' ' LEU . 51.4 t80 -56.76 -49.97 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.043 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.67 -53.39 58.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.719 -179.699 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.539 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.9 m -51.89 -51.7 55.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.451 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CZ ' HD13 ' A' ' 35' ' ' LEU . 45.0 t80 -52.06 -49.0 64.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.053 0.454 . . . . 0.0 111.119 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.544 HD13 ' CE2' ' A' ' 28' ' ' TYR . 80.4 mt -61.8 -42.13 98.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.7 mm-40 -61.03 -34.3 74.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.358 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.735 HG22 ' HB2' ' A' ' 61' ' ' GLU . 86.4 mt -61.99 -60.64 2.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.175 0.512 . . . . 0.0 110.45 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.482 HD13 ' CZ ' ' A' ' 31' ' ' PHE . 89.8 mt -57.93 -37.97 75.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.635 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.536 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.47 -43.34 99.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.13 179.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-O 121.144 0.497 . . . . 0.0 110.406 179.72 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 . . . . . 0 CA--C 1.522 -0.101 0 CA-C-O 120.723 0.296 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.529 HG12 HG23 ' A' ' 34' ' ' ILE . 37.6 t -53.25 -44.37 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.159 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.489 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.1 t80 -59.96 -37.81 80.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.326 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.7 m -72.31 -51.1 22.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.721 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.735 ' HB2' HG22 ' A' ' 34' ' ' ILE . 56.6 mm-40 -58.28 -48.17 81.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.485 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.4 t -64.12 -42.12 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.887 0.375 . . . . 0.0 110.237 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.596 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.13 -40.1 92.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.019 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -58.79 -40.45 84.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.457 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.462 HD21 HG21 ' A' ' 27' ' ' ILE . 6.1 mt -68.29 -62.85 1.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.122 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.4 ' HZ ' HD12 ' A' ' 17' ' ' ILE . 5.1 m-30 -74.82 41.41 0.16 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.669 -179.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -64.02 133.47 53.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.718 0.294 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.34 -42.09 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.242 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -81.03 56.0 2.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.63 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 54.4 mt-10 -60.01 -4.57 0.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.073 -179.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.38 -53.82 51.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.939 0.4 . . . . 0.0 110.244 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.1 mt -71.56 -33.64 69.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.417 0.627 . . . . 0.0 109.509 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.63 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -53.85 -38.72 64.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.996 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -57.8 -42.23 83.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.929 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.71 -53.95 46.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.489 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.2 t80 -58.74 -38.97 79.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.2 0.524 . . . . 0.0 110.868 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.377 0 CA-C-N 115.396 -0.82 . . . . 0.0 114.111 -178.611 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 32.1 mm . . . . . 0 CA--C 1.53 0.194 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . 0.407 ' HB2' HE21 ' B' ' 3' ' ' GLN . 0.0 OUTLIER -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.089 0.471 . . . . 0.0 109.816 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 60.2 mtm -59.12 -41.88 89.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.523 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.446 HD11 HD12 ' A' ' 35' ' ' LEU . 54.9 mt -71.02 -46.27 62.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.464 ' HA ' HD11 ' B' ' 6' ' ' LEU . 3.3 mm? -57.5 -42.66 83.16 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.287 0.565 . . . . 0.0 109.77 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.34 -40.08 85.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.918 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.13 83.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.584 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.5 -43.47 79.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -39.3 93.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.72 -57.73 9.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.494 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.651 HD13 HG13 ' A' ' 14' ' ' VAL . 97.4 mt -60.77 -47.87 84.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.347 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.865 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.909 0.385 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.7 mm -53.75 -44.18 58.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.324 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.4 p -56.44 -36.21 68.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.01 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.581 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.1 t80 -66.9 -55.54 14.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.887 0.375 . . . . 0.0 110.841 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.481 HG11 ' HE1' ' A' ' 28' ' ' TYR . 34.0 t -60.0 -44.52 94.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.3 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -60.39 -53.88 52.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.957 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HA ' HG23 ' A' ' 19' ' ' THR . 87.7 tttt -53.72 -38.52 64.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.94 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 13' ' ' TYR . 90.0 mt -61.39 -36.59 74.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.807 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.626 ' HB2' ' HZ3' ' A' ' 18' ' ' LYS . 5.2 ttmp? -64.8 -51.87 59.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.83 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -67.43 -29.3 68.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.646 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.506 ' N ' HG21 ' A' ' 19' ' ' THR . 27.1 tpt180 -64.54 -62.05 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.567 ' CD2' HG13 ' A' ' 27' ' ' ILE . 49.1 m-85 -94.83 44.66 1.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.849 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -53.53 -35.99 61.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 111.063 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -75.19 -35.91 61.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.096 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -106.15 78.56 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.365 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.48 -34.52 98.13 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.82 2.347 . . . . 0.0 112.417 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -51.79 -32.46 31.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.581 HG21 HD23 ' A' ' 65' ' ' LEU . 10.4 mm -64.5 -48.96 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.481 ' HE1' HG11 ' A' ' 14' ' ' VAL . 61.6 t80 -58.44 -50.01 75.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.995 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -59.53 -56.65 19.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.343 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.615 ' O ' HG13 ' A' ' 34' ' ' ILE . 46.8 t -44.81 -51.91 9.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.528 -179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -50.36 -47.11 56.24 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.085 0.469 . . . . 0.0 110.779 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 52.0 mt -63.26 -38.9 92.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.07 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.2 tp10 -64.69 -30.26 71.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.833 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.798 HG23 HG21 ' A' ' 62' ' ' VAL . 56.3 mt -63.78 -58.21 8.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.072 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.44 -36.25 71.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.412 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 2.2 m-70 -62.01 -48.27 81.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.4 m . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 179.952 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 . . . . . 0 N--CA 1.461 0.111 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.5 t -52.78 -43.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.172 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.568 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 28.5 t80 -62.22 -36.14 81.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.601 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -72.84 -51.64 18.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.038 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.599 ' HB3' HG22 ' A' ' 34' ' ' ILE . 74.9 tt0 -57.8 -45.11 86.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.884 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.798 HG21 HG23 ' A' ' 34' ' ' ILE . 98.7 t -64.27 -42.74 96.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.76 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -59.83 -41.93 92.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.116 178.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -60.38 -39.94 89.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.232 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.581 HD23 HG21 ' A' ' 27' ' ' ILE . 1.2 mt -62.93 -64.99 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.909 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.463 ' HZ ' HD12 ' A' ' 17' ' ' ILE . 15.1 m-30 -74.76 42.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.812 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 -59.18 129.64 43.09 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.59 -42.5 2.94 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.901 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.6 OUTLIER -81.52 50.5 1.49 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.811 0.338 . . . . 0.0 110.527 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.506 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 51.2 mt-10 -61.6 -1.15 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 69' ' ' GLN . 1.5 m-20 -61.47 -47.79 84.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.109 0.48 . . . . 0.0 110.422 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.0 mt -71.98 -35.39 69.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.267 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.76 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.05 -39.85 66.6 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.157 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.7 t -54.59 -41.06 69.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.943 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -70.2 -45.35 66.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 21.3 t80 -57.14 -45.32 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.275 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.175 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.865 -179.624 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 mm . . . . . 0 CA--C 1.527 0.078 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . 0.562 ' HG3' ' N ' ' B' ' 4' ' ' MET . 7.2 pt20 -56.77 -36.5 69.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.036 0.446 . . . . 0.0 110.233 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' MET . . . . . 0.562 ' N ' ' HG3' ' B' ' 3' ' ' GLN . 18.1 ptt? -62.82 -46.15 89.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.452 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.93 -43.76 74.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.16 0.505 . . . . 0.0 110.358 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.7 tp -60.99 -44.57 97.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.612 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -73.38 -35.17 65.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.644 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.11 -39.99 66.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.214 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.0 91.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.384 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.22 -50.67 72.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.946 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -59.24 -58.16 9.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.339 0.59 . . . . 0.0 111.163 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.559 HD22 ' NZ ' ' A' ' 18' ' ' LYS . 21.9 tp -55.65 -39.17 70.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.699 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.804 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.478 ' HB2' HD22 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-O 120.979 0.419 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.941 HG22 HD13 ' B' ' 12' ' ' LEU . 50.2 mm -51.29 -48.23 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.444 -179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.1 p -55.33 -36.5 66.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.104 -179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.637 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -62.2 -49.32 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.034 0.445 . . . . 0.0 109.942 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.4 t -66.28 -37.69 80.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.87 -44.44 89.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.335 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.542 ' HA ' HG23 ' A' ' 19' ' ' THR . 53.9 tttp -66.99 -40.09 87.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.908 0.385 . . . . 0.0 110.701 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.1 mt -60.81 -43.06 94.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.458 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 39.1 ttpt -65.44 -54.62 25.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.88 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.6 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -60.0 -29.37 68.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.317 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.402 HH11 ' HG2' ' A' ' 20' ' ' ARG . 13.1 tpp85 -65.43 -56.99 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.171 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.577 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.5 m-85 -94.94 43.11 1.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.079 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 19' ' ' THR . 70.3 mt -55.4 -34.97 64.84 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.844 0.355 . . . . 0.0 110.921 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -74.66 -38.68 62.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.488 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -105.77 78.16 0.45 Allowed Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.22 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.91 -30.69 93.78 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.655 2.237 . . . . 0.0 112.266 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -52.58 -34.01 48.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.577 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.5 mm -64.76 -48.47 84.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.455 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.463 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 11.1 t80 -57.95 -57.24 13.66 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.063 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.722 ' HE ' ' HA ' ' A' ' 29' ' ' ARG . 2.0 mmp_? -50.12 -54.47 20.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.311 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 34' ' ' ILE . 69.4 m -53.57 -51.42 63.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.565 -179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.475 ' CE1' HG12 ' A' ' 62' ' ' VAL . 37.5 t80 -53.21 -51.01 63.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.965 0.412 . . . . 0.0 110.916 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 38.8 mt -59.81 -37.18 78.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.103 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 5.0 mm-40 -66.18 -31.27 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.805 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 30' ' ' SER . 82.8 mt -61.61 -56.73 15.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.459 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.25 -39.15 85.74 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.14 -38.7 87.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.169 178.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 76.1 m . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.362 179.263 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 21.8 tt0 . . . . . 0 N--CA 1.456 -0.175 0 CA-C-O 120.401 0.143 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.466 HG11 ' HZ ' ' A' ' 76' ' ' PHE . 46.7 t -55.46 -45.59 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.038 0.447 . . . . 0.0 110.357 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.583 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 29.0 t80 -65.75 -41.9 91.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.668 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.3 m -62.46 -48.5 79.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.936 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.688 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -59.03 -52.45 65.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.639 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.475 HG12 ' CE1' ' A' ' 31' ' ' PHE . 61.6 t -65.01 -45.33 94.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.394 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.734 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.4 -43.75 98.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.536 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.688 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 2.0 p30 -61.65 -38.68 88.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.84 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.8 mt -61.33 -63.27 1.34 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.631 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CZ ' HG22 ' A' ' 17' ' ' ILE . 7.5 m-30 -75.87 43.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.473 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.3 tpt180 -59.88 136.83 58.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.805 0.336 . . . . 0.0 110.662 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.73 -45.12 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.98 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -85.05 55.91 3.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.969 0.414 . . . . 0.0 110.407 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.13 -0.31 2.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.13 -43.73 98.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 110.733 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.31 -36.46 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.373 0.606 . . . . 0.0 110.353 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.734 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.4 OUTLIER -56.13 -36.83 68.68 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.268 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.3 t -53.12 -41.18 64.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.594 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -73.01 -39.82 65.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.835 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.637 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.2 t80 -57.18 -43.18 82.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.811 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.231 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.923 -179.864 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 43.9 mm . . . . . 0 N--CA 1.458 -0.07 0 CA-C-O 120.776 0.322 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -54.97 -39.67 69.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' MET . . . . . 0.431 ' HE1' ' HB3' ' B' ' 4' ' ' MET . 57.5 mtp -64.58 -48.37 75.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.483 -179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 10' ' ' ALA . 83.9 mt -65.89 -45.88 80.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.961 0.41 . . . . 0.0 110.671 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.02 -48.29 82.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -64.1 -36.2 83.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.268 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' B' ' 11' ' ' TYR . . . -56.4 -50.63 71.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.478 ' O ' ' HG2' ' B' ' 13' ' ' GLU . . . -46.55 -44.9 18.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.214 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.14 -39.72 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.064 0.459 . . . . 0.0 110.479 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.455 ' HD2' HD11 ' B' ' 12' ' ' LEU . 74.2 t80 -60.29 -51.43 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.517 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.941 HD13 HG22 ' A' ' 11' ' ' ILE . 6.5 mp -63.13 -48.67 77.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.681 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 16.9 pt-20 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.918 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.099 0.476 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mm -52.75 -45.21 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.127 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.7 p -57.93 -35.28 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.7 t80 -62.86 -51.91 65.18 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.479 ' HB ' HD13 ' B' ' 12' ' ' LEU . 41.4 t -62.07 -42.03 93.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.416 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -60.41 -44.72 95.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.35 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.625 ' HA ' HG23 ' A' ' 19' ' ' THR . 62.3 tttp -67.79 -40.32 83.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.778 0.323 . . . . 0.0 110.607 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.4 mt -59.93 -40.96 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.306 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.24 -56.35 17.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.708 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.625 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.36 -29.5 70.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.85 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' N ' HG21 ' A' ' 19' ' ' THR . 35.1 tpt85 -65.91 -60.12 3.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.816 0.341 . . . . 0.0 111.309 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.531 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.8 m-85 -92.25 41.61 1.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.105 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.8 mt -53.49 -35.03 60.15 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.841 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -37.48 60.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.027 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.63 78.17 0.53 Allowed Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.271 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -58.95 -36.32 97.04 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.726 2.284 . . . . 0.0 112.528 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -50.5 -31.0 14.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.266 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.534 HG21 HD21 ' A' ' 65' ' ' LEU . 10.2 mm -64.33 -48.01 87.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.133 0.492 . . . . 0.0 110.471 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.494 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 57.6 t80 -62.64 -48.79 77.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.133 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -54.98 -54.81 38.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.561 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.657 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.5 t -54.06 -44.11 70.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.821 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.46 ' HA ' HD13 ' A' ' 34' ' ' ILE . 60.3 t80 -55.26 -46.4 76.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.909 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 69.6 mt -62.81 -47.25 84.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.898 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 30' ' ' SER . 24.6 pt-20 -62.69 -24.48 67.67 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.406 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.657 HG13 ' O ' ' A' ' 30' ' ' SER . 93.5 mt -66.94 -57.43 10.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.79 -40.05 82.89 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 121.525 0.679 . . . . 0.0 109.413 178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -61.86 -49.13 77.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.23 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 37.1 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.796 179.801 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 55.6 t -53.14 -47.54 55.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.766 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.56 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 30.6 t80 -63.81 -32.36 73.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.7 m -66.49 -58.3 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.942 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.545 ' HB2' HG22 ' A' ' 34' ' ' ILE . 56.0 mt-10 -57.1 -45.21 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.337 -179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.404 HG21 HG22 ' A' ' 34' ' ' ILE . 97.5 t -64.57 -42.78 96.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.628 0.251 . . . . 0.0 110.634 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.718 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -61.27 -40.86 95.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.911 0.386 . . . . 0.0 110.3 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -58.69 -39.62 81.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.131 179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.534 HD21 HG21 ' A' ' 27' ' ' ILE . 3.5 mt -67.45 -59.9 3.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.66 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -70.92 35.2 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.646 -1.161 . . . . 0.0 112.187 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 65' ' ' LEU . 38.5 ttm180 -63.1 119.86 10.34 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.08 -39.77 3.05 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.999 -179.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.427 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -83.94 53.05 2.45 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.958 0.408 . . . . 0.0 110.396 179.479 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -60.71 -7.11 2.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.019 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.648 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.7 p30 -64.08 -48.94 74.23 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.71 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.648 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 78.6 mt -72.3 -44.6 62.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.615 0.722 . . . . 0.0 109.46 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 63' ' ' ALA . 3.2 tp -52.45 -36.73 55.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.441 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 45.5 t -55.83 -44.3 77.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.582 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -66.57 -42.09 87.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.59 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.9 t80 -58.07 -44.95 87.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.68 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.898 -179.864 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 43.3 mm . . . . . 0 C--O 1.226 -0.146 0 CA-C-O 120.527 0.203 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -64.45 -46.01 84.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.175 0.512 . . . . 0.0 109.824 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.9 mtm -72.41 -41.89 65.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.975 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . 0.449 ' HA ' HD11 ' B' ' 5' ' ' LEU . 21.8 tp -64.23 -48.24 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.96 -45.33 93.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.088 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -63.99 -33.28 75.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.306 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.18 -44.03 83.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.578 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -46.5 75.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.08 -35.95 76.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.375 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' TYR . . . . . 0.442 ' C ' ' H ' ' B' ' 13' ' ' GLU . 61.9 t80 -65.15 -47.54 76.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.136 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.479 HD13 ' HB ' ' A' ' 14' ' ' VAL . 93.3 mt -75.37 23.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.637 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.442 ' H ' ' C ' ' B' ' 11' ' ' TYR . 4.2 tm-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.547 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t -59.4 -37.99 79.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.918 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -167.6 46.66 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t -54.1 160.43 1.55 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.509 0.671 . . . . 0.0 111.761 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.526 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 75.2 t -54.74 -33.97 29.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.903 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 51.5 mt-10 -58.47 -38.17 77.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.993 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.465 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.2 t80 -59.59 -58.49 8.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.408 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -64.7 -28.34 69.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.457 0.646 . . . . 0.0 109.342 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.4 t-20 -59.7 -42.36 92.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.549 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.49 -45.49 62.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.817 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.485 HD13 ' CD2' ' B' ' 11' ' ' TYR . 42.2 mm -54.65 -43.31 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.3 m -58.45 -36.37 73.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.872 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.596 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.5 t80 -63.72 -53.73 46.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.935 0.398 . . . . 0.0 110.684 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.435 ' HB ' HD13 ' B' ' 12' ' ' LEU . 33.7 t -61.36 -42.49 93.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.351 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -58.46 -57.46 12.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB2' ' HZ3' ' A' ' 16' ' ' LYS . 5.0 ttmp? -52.99 -40.03 63.5 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.504 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.9 mt -61.9 -40.96 89.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -65.23 -55.33 19.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.273 0.558 . . . . 0.0 110.689 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -60.41 -30.88 69.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.296 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -65.95 -56.38 11.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.205 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.51 ' CD2' HG13 ' A' ' 27' ' ' ILE . 54.2 m-85 -93.29 40.16 1.06 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.14 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 19' ' ' THR . 57.5 mt -55.35 -35.03 64.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.874 0.369 . . . . 0.0 110.63 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -75.43 -39.12 59.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.735 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.56 78.53 0.45 Allowed Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.244 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -60.25 -34.72 93.64 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.712 2.275 . . . . 0.0 112.388 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -51.01 -30.41 15.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.603 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.51 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -63.94 -45.75 96.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.03 0.443 . . . . 0.0 110.817 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.416 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 43.5 t80 -54.91 -48.0 73.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.868 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.5 mmp_? -54.97 -51.86 64.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.47 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.491 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.3 t -54.53 -56.76 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.996 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HA ' HD13 ' A' ' 34' ' ' ILE . 47.0 t80 -48.78 -50.72 32.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.043 0.449 . . . . 0.0 111.163 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.754 HD23 ' HB2' ' B' ' 9' ' ' ALA . 61.5 mt -60.99 -40.06 92.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.622 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.1 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.643 HG22 ' HB2' ' A' ' 61' ' ' GLU . 83.1 mt -63.87 -60.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.509 ' O ' ' HB3' ' A' ' 38' ' ' TYR . 96.6 mt -55.89 -38.47 70.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.378 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -62.79 -46.62 87.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.869 179.136 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.449 HG23 ' SD ' ' A' ' 53' ' ' MET . 94.7 m -50.98 -40.14 57.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.106 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.509 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 59.6 t80 -51.06 -50.61 58.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.447 178.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.412 ' HG3' HD23 ' B' ' 6' ' ' LEU . 3.9 mm100 -58.27 -42.08 85.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.26 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -57.29 -49.95 74.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.088 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.506 ' HB2' ' HB3' ' A' ' 53' ' ' MET . 67.5 mm-40 -80.36 47.71 0.95 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.251 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -142.31 -47.08 0.34 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.794 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 44' ' ' HIS . 91.0 mt -70.67 -145.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.767 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 31.4 m170 70.86 45.57 0.54 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.277 0.561 . . . . 0.0 109.923 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.5 p 51.37 -133.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.274 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -53.37 134.94 39.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.008 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -77.2 58.36 3.63 Favored Glycine 0 CA--C 1.517 0.19 0 CA-C-N 115.87 -0.604 . . . . 0.0 113.303 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 81.3 mtm180 -55.81 138.29 71.0 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.562 0.22 . . . . 0.0 110.76 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.92 131.66 33.81 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.601 2.201 . . . . 0.0 112.493 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -179.13 51.63 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.289 0.566 . . . . 0.0 110.269 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 53.61 60.05 3.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.197 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.84 -134.53 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.233 -0.894 . . . . 0.0 113.057 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.512 ' HE1' HG21 ' A' ' 58' ' ' VAL . 27.1 ttt -170.79 160.93 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.773 0.321 . . . . 0.0 111.216 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.473 ' OG ' ' HG2' ' A' ' 56' ' ' GLU . 78.7 p -158.75 -149.89 0.23 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -69.54 -36.0 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.45 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.1 pt-20 -53.8 -47.7 70.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.923 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -65.78 -48.83 70.47 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.714 0.292 . . . . 0.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.515 ' O ' HG22 ' A' ' 62' ' ' VAL . 48.6 t -52.9 -42.3 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.721 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.556 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.2 t80 -60.05 -38.86 84.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.642 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -70.94 -50.61 32.71 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.638 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.643 ' HB2' HG22 ' A' ' 34' ' ' ILE . 92.5 mt-10 -57.3 -47.27 81.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.239 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 58' ' ' VAL . 98.3 t -64.55 -41.38 92.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.72 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.77 -40.47 92.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.164 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -60.61 -40.72 92.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.468 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mt -63.94 -63.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.333 0.587 . . . . 0.0 110.769 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.48 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.3 m-30 -75.47 42.23 0.21 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.735 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.404 ' HG2' HH11 ' A' ' 67' ' ' ARG . 12.0 tpt180 -59.13 130.97 49.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.648 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.22 -41.93 2.08 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.188 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.424 ' C ' ' H ' ' A' ' 71' ' ' ASP . 19.7 mt-30 -82.23 53.94 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.981 0.42 . . . . 0.0 110.535 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.673 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.4 mt-10 -63.46 1.7 0.51 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.179 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.424 ' H ' ' C ' ' A' ' 69' ' ' GLN . 55.1 m-20 -61.47 -50.05 74.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.136 0.493 . . . . 0.0 109.874 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.28 -32.69 66.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.892 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.72 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.17 -38.94 68.97 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.259 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.553 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 33.4 t -56.86 -40.97 77.1 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.571 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -64.2 -50.26 68.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.463 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.596 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 14.7 t80 -58.08 -42.36 85.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.23 -34.76 81.52 Favored Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.728 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.553 ' HG3' ' O ' ' A' ' 74' ' ' SER . 25.5 mt-30 -54.01 -43.48 70.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.757 0.313 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.678 ' HB3' ' HB2' ' B' ' 1' ' ' ASN . 5.7 m-85 -67.93 -47.71 67.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.517 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.2 mt -67.78 147.54 98.58 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.546 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -55.79 128.1 28.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.311 2.007 . . . . 0.0 112.307 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.06 132.51 48.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.99 -145.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.232 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -69.93 141.52 53.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.061 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.456 ' HD2' ' C ' ' A' ' 85' ' ' ARG . 4.1 tmm_? . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.318 -0.848 . . . . 0.0 110.5 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.678 ' HB2' ' HB3' ' A' ' 79' ' ' PHE . 20.9 p30 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.803 0.335 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.412 HG12 ' OD1' ' B' ' 1' ' ' ASN . 46.9 mm -63.86 -32.68 58.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.836 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -55.19 -40.91 71.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -66.22 -46.82 75.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.862 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.433 HD23 ' HD2' ' A' ' 13' ' ' TYR . 70.2 mt -67.41 -48.83 66.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.848 0.356 . . . . 0.0 111.181 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.412 HD23 ' HG3' ' A' ' 39' ' ' GLN . 67.7 tp -57.11 -45.03 83.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.591 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.74 -37.38 76.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.838 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.04 -41.78 65.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.557 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.754 ' HB2' HD23 ' A' ' 32' ' ' LEU . . . -54.58 -45.39 73.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.29 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -62.58 -39.41 93.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.722 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.485 ' CD2' HD13 ' A' ' 11' ' ' ILE . 45.4 t80 -57.53 -55.01 40.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.411 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.435 HD13 ' HB ' ' A' ' 14' ' ' VAL . 97.5 mt -63.62 -45.27 91.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.92 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -161.93 -52.2 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.687 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -73.76 76.74 1.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.858 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 t -50.96 148.74 3.99 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.555 0.693 . . . . 0.0 111.852 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.575 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 74.9 t -55.44 -39.11 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.057 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 92.4 mt-10 -59.8 -36.8 77.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -61.65 -59.53 5.05 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 -62.98 -29.34 70.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.446 0.641 . . . . 0.0 109.314 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.575 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.0 t-20 -57.18 -43.69 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.543 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.79 -43.94 71.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.525 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.523 ' HA ' ' HB3' ' B' ' 8' ' ' ALA . 38.1 mm -50.58 -45.42 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.964 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 48.3 t -57.74 -38.9 76.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.597 -178.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.9 t80 -61.96 -52.0 65.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.794 HG22 ' HB2' ' B' ' 8' ' ' ALA . 26.4 t -63.05 -36.08 74.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.599 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.427 ' HB2' HD12 ' B' ' 12' ' ' LEU . 17.0 t-20 -66.32 -47.18 74.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.531 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' SER . 24.9 mtpp -61.54 -41.14 96.9 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 13' ' ' TYR . 96.7 mt -59.67 -37.53 71.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.841 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.468 ' O ' HD22 ' A' ' 22' ' ' LEU . 26.0 ttpp -67.27 -49.85 62.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.956 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.531 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.9 t -71.28 -28.16 63.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.91 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -65.33 -59.87 3.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.955 0.407 . . . . 0.0 111.253 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.55 ' CD2' HG13 ' A' ' 27' ' ' ILE . 66.9 m-85 -93.7 41.54 1.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.774 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 19' ' ' THR . 65.6 mt -54.16 -34.99 61.78 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.631 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -75.27 -37.75 60.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.428 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -106.71 78.56 0.57 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.25 -32.95 97.06 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.729 2.286 . . . . 0.0 112.327 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.24 -34.95 34.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.917 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.55 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.6 mm -64.58 -47.75 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.536 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 13.3 t80 -61.51 -59.32 5.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.602 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.456 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 22.4 mmt85 -49.79 -53.66 23.88 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.807 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.527 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.9 p -51.9 -51.54 56.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.075 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.469 ' CD1' HG23 ' A' ' 62' ' ' VAL . 46.0 t80 -51.25 -50.06 59.95 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.076 0.465 . . . . 0.0 110.509 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 47.7 mt -57.36 -41.7 80.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.008 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 50.4 mt-10 -64.61 -30.21 71.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.531 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.716 HD13 HD13 ' A' ' 65' ' ' LEU . 66.6 mt -62.44 -54.55 32.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 120.968 0.413 . . . . 0.0 109.927 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HB3' ' A' ' 38' ' ' TYR . 63.2 mt -61.7 -39.16 90.5 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -59.78 -42.61 93.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.938 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.572 HG23 ' SD ' ' A' ' 53' ' ' MET . 83.6 m -62.6 -39.16 92.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.214 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.482 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 42.4 t80 -54.12 -57.73 9.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.801 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.1 mm100 -61.0 -41.86 97.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 68.4 mttm -58.28 -46.7 85.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.703 0.287 . . . . 0.0 111.443 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -66.6 -47.01 74.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.468 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -60.34 -48.83 80.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.404 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 44' ' ' HIS . 95.6 mt -62.34 135.24 57.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.081 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 34.9 m170 81.41 120.96 0.05 OUTLIER 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 71.2 p -66.48 -140.68 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.575 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? 56.63 61.75 2.54 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.849 0.356 . . . . 0.0 110.939 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -159.87 141.74 7.71 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.487 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.458 ' HB2' ' HB2' ' A' ' 51' ' ' ARG . 98.6 mtt180 -52.68 137.97 42.72 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-O 120.644 0.259 . . . . 0.0 111.028 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.95 124.79 12.25 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.503 2.135 . . . . 0.0 112.237 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.7 t80 52.18 46.6 26.34 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.401 0.62 . . . . 0.0 110.591 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.458 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 36.5 mmt180 -147.99 59.29 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.847 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -158.6 -106.91 0.23 Allowed Glycine 0 CA--C 1.508 -0.352 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.862 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.585 ' HE1' HG23 ' A' ' 58' ' ' VAL . 27.3 ttt -137.93 144.34 41.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.991 0.424 . . . . 0.0 111.413 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.471 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 79.1 p -161.1 -154.59 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.366 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -60.74 -33.22 72.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.703 0.287 . . . . 0.0 111.309 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.4 pt-20 -62.03 -50.75 70.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 29.7 tt0 -73.21 -44.2 60.04 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.585 HG23 ' HE1' ' A' ' 53' ' ' MET . 98.4 t -52.97 -43.37 47.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.037 0.446 . . . . 0.0 110.219 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.575 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.6 t80 -62.59 -35.17 78.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.502 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.8 m -67.16 -56.53 9.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.065 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.641 ' HB2' HG22 ' A' ' 34' ' ' ILE . 57.2 mm-40 -56.87 -44.49 82.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.417 -179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.469 HG23 ' CD1' ' A' ' 31' ' ' PHE . 98.0 t -64.09 -41.71 93.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.201 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.711 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.57 -43.59 97.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.103 0.478 . . . . 0.0 110.271 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -61.45 -40.2 93.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.617 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.716 HD13 HD13 ' A' ' 34' ' ' ILE . 2.8 mt -62.87 -63.83 1.1 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.45 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.468 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.1 m-30 -75.28 42.25 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.66 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -61.5 133.46 55.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 0.0 110.226 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.47 -45.58 3.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.776 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.7 OUTLIER -84.15 49.78 1.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.806 0.336 . . . . 0.0 110.318 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.609 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.7 mt-10 -65.19 6.32 0.28 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.638 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.9 p30 -66.88 -45.51 77.84 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.638 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 60.3 mt -72.72 -34.98 67.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.747 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.711 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -51.45 -43.88 62.21 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.223 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 35.2 t -55.88 -41.04 73.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.931 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -64.35 -45.51 87.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.698 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.607 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.0 t80 -57.96 -43.8 86.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.885 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.54 -23.47 73.7 Favored Glycine 0 CA--C 1.519 0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.556 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 74' ' ' SER . 12.6 mm100 -44.53 -53.97 6.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.901 0.35 . . . . 0.0 111.69 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -76.37 -38.71 55.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.886 0.374 . . . . 0.0 110.572 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 76' ' ' PHE . 61.4 mt -60.81 151.67 72.04 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.879 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.57 138.73 81.5 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.604 2.203 . . . . 0.0 112.276 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -57.65 -40.4 79.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.334 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.66 143.89 23.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.512 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.5 tttm -163.02 -60.56 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.001 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.028 -179.84 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.687 ' H1 ' ' HG2' ' B' ' 4' ' ' MET . 5.0 m120 . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.534 0.207 . . . . 0.0 110.984 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 48.5 mm -63.59 -30.84 50.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.772 0.32 . . . . 0.0 111.361 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' B' ' 3' ' ' GLN . 0.0 OUTLIER -61.02 -48.64 80.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.876 -179.526 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' MET . . . . . 0.687 ' HG2' ' H1 ' ' B' ' 1' ' ' ASN . 23.6 ptp -73.12 -40.82 64.61 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.148 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.44 ' HA ' HD11 ' B' ' 5' ' ' LEU . 26.7 tp -60.87 -50.73 72.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.032 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 34.5 tp -63.18 -40.81 98.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.149 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -60.6 -34.36 74.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.991 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.794 ' HB2' HG22 ' A' ' 14' ' ' VAL . . . -56.53 -42.29 78.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.141 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.72 87.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.05 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -61.01 -42.81 99.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.454 ' CD2' HD13 ' A' ' 11' ' ' ILE . 39.8 t80 -61.28 -55.38 32.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.176 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.427 HD12 ' HB2' ' A' ' 15' ' ' ASN . 89.6 mt -60.81 -35.21 75.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.015 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.977 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.532 0.205 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 t -58.37 -50.55 73.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 111.076 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -66.95 127.85 34.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.681 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 p -62.08 143.21 56.95 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.536 0.684 . . . . 0.0 112.462 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.04 -41.51 68.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.111 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 51.5 mt-10 -53.32 -35.15 59.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.136 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.494 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.9 t80 -65.06 -64.8 0.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.4 m-80 -59.32 -43.84 92.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.13 0.491 . . . . 0.0 110.187 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -55.04 -41.52 71.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.667 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 6' ' ' GLU . . . -63.49 -39.77 95.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.937 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 7' ' ' PHE . 39.1 mm -60.77 -44.7 97.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.501 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 t -59.43 -42.29 91.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.546 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 12.6 t80 -59.37 -51.78 68.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.911 0.386 . . . . 0.0 110.501 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.532 HG13 HD13 ' B' ' 12' ' ' LEU . 47.7 t -57.33 -44.12 83.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -59.2 -58.27 9.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.173 0.511 . . . . 0.0 110.882 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.664 ' HA ' HG23 ' A' ' 19' ' ' THR . 40.7 ttmt -53.45 -38.95 64.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.715 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 13' ' ' TYR . 71.0 mt -61.77 -40.84 88.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.068 0.461 . . . . 0.0 110.149 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.699 ' HZ2' HD11 ' B' ' 12' ' ' LEU . 3.4 ttmp? -65.17 -55.41 18.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.664 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.4 t -61.22 -30.29 70.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.79 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.453 ' N ' HG21 ' A' ' 19' ' ' THR . 26.8 tpt180 -63.75 -57.61 9.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.236 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.518 ' CD2' HG13 ' A' ' 27' ' ' ILE . 53.7 m-85 -95.52 43.44 1.09 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.047 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 19' ' ' THR . 66.6 mt -55.58 -35.5 65.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 110.751 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -74.77 -37.2 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.727 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -107.17 77.51 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.517 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.072 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -59.35 -33.72 97.66 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.591 2.194 . . . . 0.0 112.329 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -50.76 -32.28 19.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.044 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.518 HG13 ' CD2' ' A' ' 21' ' ' PHE . 7.8 mm -64.39 -47.8 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.706 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.552 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.2 t80 -59.8 -49.68 76.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.119 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -55.87 -53.2 59.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.589 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -52.88 -47.41 67.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.842 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.505 ' HA ' HD11 ' A' ' 34' ' ' ILE . 41.9 t80 -53.7 -48.57 69.41 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.169 0.509 . . . . 0.0 110.88 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 51.9 mt -59.71 -46.76 88.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.438 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.525 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 44.2 tt0 -58.81 -30.59 67.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 30' ' ' SER . 97.2 mt -62.24 -60.45 2.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.702 ' HB2' HD11 ' B' ' 6' ' ' LEU . 58.6 mt -59.95 -35.84 75.8 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 15.3 m-70 -61.63 -42.98 99.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.943 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.1 m -62.66 -37.17 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.167 0.508 . . . . 0.0 110.319 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -58.89 -61.39 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.47 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -61.69 -45.9 92.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.375 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.502 ' HZ2' ' HB3' ' A' ' 36' ' ' HIS . 62.2 mttp -56.28 -49.52 74.01 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -80.17 43.1 0.6 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.767 0.318 . . . . 0.0 111.262 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -152.23 -52.11 0.11 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.702 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.2 mt -72.57 -59.06 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.989 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -94.04 -41.11 9.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.601 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.4 m 66.71 130.27 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.993 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 46' ' ' LYS . 40.8 tptt -177.29 117.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.264 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.72 152.79 6.17 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.702 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.452 HH11 ' HG3' ' A' ' 48' ' ' ARG . 60.0 mtt85 -49.64 146.75 6.81 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.566 0.222 . . . . 0.0 110.957 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -49.0 144.52 15.5 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.969 2.446 . . . . 0.0 112.707 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -158.28 163.59 37.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.196 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -74.66 43.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.94 164.3 0.93 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.601 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.514 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 24.4 ttt -146.43 144.8 29.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.349 -0.426 . . . . 0.0 110.942 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.514 ' HG ' ' HG2' ' A' ' 56' ' ' GLU . 78.8 p -169.31 -144.47 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.487 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -56.9 -31.04 64.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.838 0.352 . . . . 0.0 110.895 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.514 ' HG2' ' HG ' ' A' ' 54' ' ' SER . 14.6 pt-20 -58.42 -50.28 74.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.9 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.514 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 28.2 tt0 -79.25 -44.7 21.23 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 54' ' ' SER . 65.7 t -52.83 -41.14 38.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.724 0.297 . . . . 0.0 110.848 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.471 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 21.0 t80 -61.71 -39.13 90.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.401 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 16.4 m -67.59 -50.83 56.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.882 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.647 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 57.8 mm-40 -56.88 -48.68 77.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.484 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.557 HG21 HG23 ' A' ' 34' ' ' ILE . 61.5 t -68.48 -44.99 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.81 0.338 . . . . 0.0 111.586 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.676 ' HB3' HD13 ' A' ' 73' ' ' LEU . . . -61.1 -44.2 97.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.506 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.647 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 1.1 p30 -62.42 -38.96 91.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.109 0.481 . . . . 0.0 110.247 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD13 HD13 ' A' ' 34' ' ' ILE . 3.0 mt -60.05 -63.1 1.42 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.191 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.485 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 9.8 m-30 -74.2 41.19 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.597 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HG2' HH11 ' A' ' 67' ' ' ARG . 53.1 ttt-85 -61.06 131.86 51.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.361 . . . . 0.0 110.531 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -45.35 3.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.562 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.61 53.88 2.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.035 0.445 . . . . 0.0 110.341 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.55 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 95.5 mt-10 -59.97 -5.54 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.023 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -60.85 -45.23 95.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 0.0 110.018 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.98 -36.11 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.985 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.676 HD13 ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -53.41 -44.25 68.59 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.73 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 67.3 m -53.47 -41.33 66.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.815 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.93 -46.91 70.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.08 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.546 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.9 t80 -57.7 -41.76 82.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.161 0.505 . . . . 0.0 110.021 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.68 -30.07 75.71 Favored Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.76 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 74' ' ' SER . 99.0 mm-40 -50.67 -47.06 58.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.714 0.292 . . . . 0.0 110.997 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -68.33 -48.36 65.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.037 0.446 . . . . 0.0 110.563 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.58 133.16 95.61 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.416 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.46 105.97 0.39 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 121.959 1.773 . . . . 0.0 111.91 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.15 144.15 56.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -160.86 -50.44 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.713 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -72.08 -150.71 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.756 0.312 . . . . 0.0 111.167 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 48.1 ttm-85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.901 -179.912 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.936 0.398 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.443 ' HA ' HD11 ' B' ' 2' ' ' ILE . 44.7 mm -71.45 -36.53 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.112 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -41.34 68.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.498 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 64.4 mtt -70.31 -42.54 71.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.212 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.537 HD12 ' HD2' ' A' ' 13' ' ' TYR . 19.6 tp -64.42 -49.08 72.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.824 0.345 . . . . 0.0 110.968 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.702 HD11 ' HB2' ' A' ' 35' ' ' LEU . 30.8 tp -63.45 -43.25 97.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.15 -34.45 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.158 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.465 ' HB3' HG22 ' A' ' 14' ' ' VAL . . . -54.15 -38.97 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.94 -45.22 74.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.002 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -63.72 -39.15 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.59 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -55.83 -54.21 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.506 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.699 HD11 ' HZ2' ' A' ' 18' ' ' LYS . 95.8 mt -63.69 -45.86 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.266 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.861 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.372 0.13 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.4 p 57.76 130.23 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.65 0.594 . . . . 0.0 111.809 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -70.86 -133.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.83 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 p -55.93 151.25 11.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.43 0.633 . . . . 0.0 112.179 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 72.8 t -55.38 -37.01 42.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.269 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 45.7 mt-10 -57.16 -36.41 70.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.159 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.6 t80 -58.95 -57.72 11.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.716 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -32.61 74.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.552 0.691 . . . . 0.0 109.33 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.8 t-20 -56.02 -42.33 76.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 -42.14 65.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.011 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 7' ' ' PHE . 41.8 mm -54.02 -42.99 57.07 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.817 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 m -54.53 -38.53 66.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.132 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 39.4 t80 -66.86 -57.46 6.96 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.931 0.396 . . . . 0.0 111.019 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.493 HG13 ' HA ' ' B' ' 9' ' ' ALA . 39.5 t -57.19 -43.89 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.269 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.54 -52.39 63.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.993 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' O ' HG21 ' A' ' 19' ' ' THR . 5.0 ttmp? -53.36 -40.08 64.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.0 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.704 HG12 HD12 ' A' ' 72' ' ' LEU . 91.9 mt -62.31 -38.19 80.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.19 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -68.97 -49.23 59.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.075 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.6 t -69.82 -27.97 65.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.654 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.426 ' N ' HG21 ' A' ' 19' ' ' THR . 10.5 tpt180 -67.73 -58.45 4.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.571 ' HZ ' ' HG3' ' A' ' 69' ' ' GLN . 53.1 m-85 -90.94 38.89 0.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' THR . 72.7 mt -54.24 -34.87 61.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.044 0.449 . . . . 0.0 110.342 179.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.23 -37.22 61.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.42 78.69 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.121 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -59.04 -35.15 98.89 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.84 2.36 . . . . 0.0 112.809 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -50.84 -33.09 22.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.378 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.498 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.4 mm -64.54 -48.35 85.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.117 0.484 . . . . 0.0 111.036 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.53 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.0 t80 -59.27 -49.89 76.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.409 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -58.3 -56.17 25.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.041 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.569 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.7 m -53.44 -49.76 66.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.528 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.421 ' O ' ' HB ' ' A' ' 34' ' ' ILE . 57.5 t80 -52.03 -49.68 62.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.986 0.422 . . . . 0.0 111.068 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 86.6 mt -58.66 -41.73 86.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.475 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.61 -30.25 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.121 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.798 HG22 ' HB2' ' A' ' 61' ' ' GLU . 78.1 mt -62.41 -55.1 26.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.6 ' HB2' HD12 ' B' ' 6' ' ' LEU . 54.2 mt -62.83 -38.62 91.51 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.449 0.643 . . . . 0.0 109.534 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.541 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 1.8 m-70 -60.82 -47.23 87.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.221 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.4 m -61.18 -37.02 81.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.597 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 30.2 t80 -54.0 -60.21 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.162 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 14.2 mt-30 -60.47 -39.52 87.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.134 -179.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 28.6 mtpp -52.24 -54.45 30.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.619 0.247 . . . . 0.0 111.548 -179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.419 ' OE2' ' HA2' ' A' ' 52' ' ' GLY . 87.4 tt0 -72.99 -32.93 65.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.876 0.369 . . . . 0.0 110.742 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 39' ' ' GLN . 7.5 tt0 -56.86 -40.53 76.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.517 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 80.7 mt -63.84 -147.72 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.803 0.335 . . . . 0.0 111.419 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -178.3 142.11 0.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.6 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 p -127.82 107.78 10.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HD3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER 47.72 45.38 18.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.159 179.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.55 148.31 8.03 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.885 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -52.27 143.41 25.92 Favored Pre-proline 0 C--N 1.332 -0.179 0 CA-C-O 120.625 0.25 . . . . 0.0 111.111 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.14 -160.89 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.68 2.254 . . . . 0.0 112.625 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.402 ' C ' ' H ' ' A' ' 52' ' ' GLY . 20.0 t80 -173.21 134.02 0.53 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.514 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -81.31 36.9 0.43 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.318 0.58 . . . . 0.0 110.898 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.419 ' HA2' ' OE2' ' A' ' 41' ' ' GLU . . . -62.24 -35.27 91.33 Favored Glycine 0 CA--C 1.509 -0.332 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.613 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.522 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 26.7 ttt -144.94 143.28 30.46 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.859 0.362 . . . . 0.0 111.026 -179.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.597 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 10.3 t -162.05 -145.64 0.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.444 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -61.0 -34.98 75.66 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.814 0.34 . . . . 0.0 111.161 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 16.0 pt-20 -56.27 -49.53 73.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.053 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.522 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 75.9 tt0 -74.47 -46.53 39.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.546 HG23 ' HB2' ' A' ' 38' ' ' TYR . 59.6 t -53.55 -45.79 59.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.822 0.344 . . . . 0.0 110.832 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.576 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.4 t80 -60.23 -34.74 74.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.278 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.4 m -66.93 -58.81 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.048 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.798 ' HB2' HG22 ' A' ' 34' ' ' ILE . 66.7 mm-40 -56.72 -44.32 81.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.396 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.702 HG21 HD11 ' A' ' 34' ' ' ILE . 90.1 t -64.05 -42.17 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.474 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.37 -40.54 94.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.087 0.47 . . . . 0.0 110.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -61.29 -42.66 99.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.698 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.48 HD13 HD13 ' A' ' 34' ' ' ILE . 5.5 mt -67.13 -62.7 1.3 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.316 0.579 . . . . 0.0 110.952 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 3.3 m-30 -73.11 37.47 0.08 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.634 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.435 ' C ' ' H ' ' A' ' 69' ' ' GLN . 41.8 ttm180 -58.48 130.84 48.68 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.36 -31.83 2.1 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.764 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.571 ' HG3' ' HZ ' ' A' ' 21' ' ' PHE . 6.4 mm-40 -78.04 48.76 0.75 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.911 0.386 . . . . 0.0 110.492 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.489 ' OE1' ' HA ' ' A' ' 70' ' ' GLU . 4.9 mm-40 -56.08 -14.49 2.67 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.27 -49.83 75.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.639 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.704 HD12 HG12 ' A' ' 17' ' ' ILE . 88.0 mt -70.0 -34.04 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.234 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 1.3 mm? -58.51 -37.38 75.48 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.525 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 74.8 m -54.71 -39.26 68.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.322 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.51 -45.27 22.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.292 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.606 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.8 t80 -57.23 -43.78 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.134 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -39.59 96.69 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.989 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 74' ' ' SER . 26.1 mt-30 -53.62 -46.77 70.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.774 0.321 . . . . 0.0 111.14 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.694 ' HB3' ' HB2' ' B' ' 1' ' ' ASN . 2.4 m-85 -65.76 -42.73 90.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.632 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.85 134.78 95.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.747 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -69.09 114.6 3.65 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.251 1.967 . . . . 0.0 112.505 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 178.79 -55.16 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.841 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.57 133.36 46.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.26 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -175.37 46.39 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.021 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.965 179.662 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 79' ' ' PHE . 15.6 p-10 . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.782 0.325 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 45.9 mm -62.86 -40.12 87.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.178 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -54.75 -40.97 69.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.753 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 50.8 ttm -65.4 -45.38 84.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.498 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.66 -50.22 65.76 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 35' ' ' LEU . 38.8 tp -58.02 -41.02 82.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.084 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -66.27 -37.54 85.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.287 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.71 91.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.266 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.493 ' HA ' HG13 ' A' ' 14' ' ' VAL . . . -56.83 -46.84 81.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.119 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.401 ' HA ' ' HG2' ' B' ' 13' ' ' GLU . 8.2 t70 -57.47 -38.58 74.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.268 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.511 ' CD2' HD13 ' A' ' 11' ' ' ILE . 57.1 t80 -60.47 -50.66 72.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.436 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.431 HD22 ' CG2' ' A' ' 11' ' ' ILE . 86.2 mt -63.09 -49.81 73.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.804 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' B' ' 10' ' ' ASP . 16.4 pt-20 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.867 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 1' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.703 0.287 . . . . 0.0 111.046 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -177.94 51.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.925 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -161.56 133.85 5.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.873 0.368 . . . . 0.0 111.273 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -65.35 142.49 58.21 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.184 0.516 . . . . 0.0 111.473 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 96.6 t -62.24 -41.37 91.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.404 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.2 mt-10 -56.83 -37.26 70.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.606 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.575 ' O ' HG12 ' A' ' 11' ' ' ILE . 16.4 t80 -59.54 -57.74 11.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.626 0.251 . . . . 0.0 110.716 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -32.21 73.74 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.471 0.653 . . . . 0.0 109.267 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.4 t-20 -55.43 -44.3 76.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.708 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.611 ' HB2' ' HE2' ' A' ' 79' ' ' PHE . . . -72.42 -42.69 64.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.827 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.575 HG12 ' O ' ' A' ' 7' ' ' PHE . 48.8 mm -51.63 -54.26 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.112 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.6 p -51.03 -33.62 26.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.552 ' O ' HG13 ' A' ' 17' ' ' ILE . 30.9 t80 -63.2 -48.72 77.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.807 HG22 ' HB2' ' B' ' 8' ' ' ALA . 32.3 t -68.3 -40.24 82.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.742 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -62.24 -42.72 99.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.908 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.626 ' HA ' HG23 ' A' ' 19' ' ' THR . 40.2 ttmt -66.24 -39.34 89.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.36 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 13' ' ' TYR . 85.7 mt -60.02 -40.82 84.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.175 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.403 ' HZ2' ' HH ' ' A' ' 28' ' ' TYR . 24.0 ttmm -64.47 -56.77 11.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.6 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.626 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.69 -29.67 70.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.008 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.416 ' N ' HG21 ' A' ' 19' ' ' THR . 27.8 tpt180 -68.09 -59.6 3.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.929 0.395 . . . . 0.0 111.283 -179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.542 ' CD2' HG13 ' A' ' 27' ' ' ILE . 60.3 m-85 -91.75 39.17 1.0 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.09 -37.24 53.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.964 0.411 . . . . 0.0 110.577 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.92 -37.46 58.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -104.16 78.61 0.34 Allowed Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.269 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -59.35 -35.42 96.69 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.87 2.38 . . . . 0.0 112.602 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -51.07 -33.12 24.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.048 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.542 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -64.44 -51.28 70.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.804 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.474 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 49.0 t80 -58.03 -47.73 82.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.629 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.41 ' HG2' HH11 ' A' ' 29' ' ' ARG . 49.7 mmt-85 -55.97 -52.22 64.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.319 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.618 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.0 m -53.69 -52.82 58.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.522 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.43 ' HA ' HD13 ' A' ' 34' ' ' ILE . 54.9 t80 -50.16 -51.67 41.66 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.088 0.47 . . . . 0.0 110.97 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' B' ' 9' ' ' ALA . 74.4 mt -58.17 -44.55 88.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.41 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.463 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 17.6 tp10 -62.13 -29.18 70.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.691 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 30' ' ' SER . 72.2 mt -64.33 -56.75 14.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.021 0.438 . . . . 0.0 109.935 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.631 ' HB2' HD12 ' B' ' 6' ' ' LEU . 56.9 mt -62.71 -40.08 96.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.458 0.647 . . . . 0.0 109.322 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.519 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 12.1 m-70 -59.14 -47.5 85.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.649 HG23 ' SD ' ' A' ' 53' ' ' MET . 76.5 m -59.86 -38.4 82.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.738 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.419 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 39.5 t80 -58.28 -53.81 54.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.669 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.2 mm100 -66.09 -43.64 86.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.967 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 99.1 mttt -56.79 -46.78 81.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.714 0.292 . . . . 0.0 111.307 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 41' ' ' GLU . 37.4 tt0 -80.05 42.33 0.56 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.181 0.515 . . . . 0.0 110.818 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -156.47 -41.84 0.07 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 95.5 mt -57.01 -41.79 79.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.243 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.49 130.66 1.37 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 111.147 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 81.9 p -98.66 136.98 37.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.416 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.629 ' HB2' ' HZ2' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -66.26 -32.8 74.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.582 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -156.05 -140.67 3.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.381 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -65.56 134.59 95.51 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.678 0.275 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -75.6 148.76 33.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.739 2.293 . . . . 0.0 112.481 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -162.74 133.08 4.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.584 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.43 HH11 ' HG3' ' A' ' 51' ' ' ARG . 0.0 OUTLIER 57.03 56.67 5.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.384 0.611 . . . . 0.0 110.062 -179.706 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.3 137.82 44.3 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.23 -0.896 . . . . 0.0 113.253 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.649 ' SD ' HG23 ' A' ' 37' ' ' THR . 27.2 ttt -95.86 146.73 24.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.727 -0.736 . . . . 0.0 110.992 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.53 ' OG ' ' HG2' ' A' ' 56' ' ' GLU . 80.9 p -154.5 -159.35 0.95 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.059 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -62.56 -35.11 78.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.533 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.53 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 11.9 pt-20 -58.57 -47.56 83.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.506 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.424 ' O ' ' HB ' ' A' ' 60' ' ' THR . 24.0 tt0 -71.09 -44.5 65.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.523 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.603 HG12 HG23 ' A' ' 34' ' ' ILE . 61.0 t -53.66 -43.46 54.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.872 0.368 . . . . 0.0 110.358 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.596 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 31.3 t80 -61.74 -33.61 74.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.197 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 45.3 m -68.0 -57.2 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.138 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.508 ' HB2' HG22 ' A' ' 34' ' ' ILE . 92.8 mt-10 -57.32 -43.06 83.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.513 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 89.4 t -64.16 -41.35 92.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 110.119 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.745 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -60.63 -40.92 93.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -63.28 -37.55 87.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.936 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD21 HG21 ' A' ' 27' ' ' ILE . 5.6 mt -65.63 -65.45 0.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.494 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.665 ' HB2' HD22 ' A' ' 73' ' ' LEU . 8.3 m-30 -76.03 44.9 0.33 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.562 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -62.69 137.23 58.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.66 -43.98 2.87 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.295 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' A' ' 71' ' ' ASP . 16.9 pt20 -96.16 56.45 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.757 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 57.8 mp0 -65.81 8.36 0.19 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.153 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.462 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.3 t70 -61.49 -44.64 96.72 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.25 -38.59 75.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.596 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.745 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -55.19 -39.77 69.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.946 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.7 t -56.13 -40.24 73.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.525 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -68.39 -44.45 75.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.793 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.596 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.0 t80 -56.97 -42.0 79.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.803 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.53 -40.63 96.53 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.763 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -53.35 -42.41 66.78 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.73 0.3 . . . . 0.0 111.042 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.611 ' HE2' ' HB2' ' A' ' 10' ' ' ALA . 5.0 m-85 -63.34 -44.9 93.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.99 0.424 . . . . 0.0 110.497 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 67.1 mt -63.89 139.24 97.61 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.708 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.41 137.82 80.51 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.621 2.214 . . . . 0.0 112.146 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -78.08 40.19 0.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.464 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.77 -170.45 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.71 0.29 . . . . 0.0 111.127 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' HD3' ' C ' ' A' ' 84' ' ' LYS . 8.0 tmtm? -177.27 123.14 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.213 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 84' ' ' LYS . 3.5 ptp85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.072 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.88 0.372 . . . . 0.0 111.266 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.51 -36.0 46.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.814 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -57.51 -45.37 85.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.571 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 77.4 mtp -71.89 -43.61 65.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.722 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.05 -51.33 69.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.825 0.345 . . . . 0.0 110.795 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.631 HD12 ' HB2' ' A' ' 35' ' ' LEU . 29.8 tp -60.76 -38.42 85.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.098 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.85 -35.62 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.807 ' HB2' HG22 ' A' ' 14' ' ' VAL . . . -54.25 -39.61 66.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.317 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.549 ' HB3' HD23 ' A' ' 32' ' ' LEU . . . -54.66 -44.48 73.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -63.6 -39.29 94.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.928 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -57.85 -54.5 46.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.52 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -63.05 -47.38 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.114 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.871 179.96 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.807 0.337 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t -171.08 133.43 0.88 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.808 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.2 131.86 50.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.823 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.3 p -63.84 150.77 44.05 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 112.049 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 76.7 t -55.26 -37.26 43.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.122 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.3 mt-10 -59.67 -35.27 74.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.364 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.443 ' O ' HG12 ' A' ' 11' ' ' ILE . 15.4 t80 -59.84 -56.76 17.77 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.514 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -33.81 76.79 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.448 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.5 t-20 -55.62 -41.42 73.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.809 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.28 -39.11 71.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.778 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 7' ' ' PHE . 37.7 mm -52.61 -42.59 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.271 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.1 t -54.96 -38.03 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.107 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.584 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.6 t80 -67.48 -56.91 7.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.408 HG11 ' HE1' ' A' ' 28' ' ' TYR . 44.6 t -57.33 -40.43 74.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.217 0.532 . . . . 0.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.02 -54.97 21.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.053 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HA ' HG23 ' A' ' 19' ' ' THR . 63.4 tttm -53.71 -39.72 65.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.06 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 13' ' ' TYR . 87.2 mt -62.73 -37.57 79.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.822 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -66.12 -47.93 72.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.916 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.534 ' HA ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -70.74 -28.86 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.176 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.511 ' N ' HG21 ' A' ' 19' ' ' THR . 26.4 tpt180 -65.22 -56.7 11.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.3 m-85 -91.89 40.35 1.04 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.604 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 35.7 mt -56.61 -31.88 64.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.934 0.397 . . . . 0.0 110.649 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -74.71 -38.05 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.315 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -106.66 78.92 0.59 Allowed Pre-proline 0 N--CA 1.447 -0.581 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.412 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 20.8 Cg_endo -58.98 -35.02 99.34 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.765 2.31 . . . . 0.0 112.604 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -53.01 -29.66 30.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.186 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.482 HG13 ' CD2' ' A' ' 21' ' ' PHE . 15.5 mm -64.25 -49.31 81.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.37 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.607 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.4 t80 -55.59 -50.83 69.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.847 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.43 -51.03 71.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.477 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.559 ' O ' HG13 ' A' ' 34' ' ' ILE . 48.3 t -52.31 -53.65 41.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.352 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -50.47 -50.36 52.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.254 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 29.4 mt -59.92 -40.55 89.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.4 mm-40 -64.73 -32.7 74.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.193 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.7 HG22 ' HB2' ' A' ' 61' ' ' GLU . 75.9 mt -61.47 -54.17 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 120.867 0.365 . . . . 0.0 110.367 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.618 HD21 HG21 ' B' ' 2' ' ' ILE . 77.5 mt -61.92 -42.3 98.93 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.522 ' HA ' HD23 ' B' ' 6' ' ' LEU . 0.4 OUTLIER -56.56 -46.16 80.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.918 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 95.8 m -48.45 -34.76 11.59 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.971 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.468 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 68.1 t80 -55.83 -52.9 62.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.297 0.57 . . . . 0.0 110.813 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -70.46 -34.46 72.45 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.692 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 75.2 mmtt -52.72 -47.99 66.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.807 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.83 -43.75 92.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.685 0.278 . . . . 0.0 111.578 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -65.71 -33.44 75.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.353 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.34 45.19 0.45 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.025 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.2 m170 -121.91 5.55 9.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.642 0.258 . . . . 0.0 110.828 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.708 HG21 ' HG2' ' A' ' 46' ' ' LYS . 22.6 m 62.86 140.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.352 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.708 ' HG2' HG21 ' A' ' 45' ' ' THR . 46.4 mmtm 62.75 140.69 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.331 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.47 125.66 1.28 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.955 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' HG2' HH11 ' A' ' 48' ' ' ARG . 69.6 mtt-85 -81.81 146.73 56.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.535 0.207 . . . . 0.0 110.938 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.472 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 9.5 Cg_endo -52.22 144.33 39.14 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.82 2.347 . . . . 0.0 111.655 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' A' ' 51' ' ' ARG . 36.2 t80 70.09 155.04 0.13 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.704 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 50' ' ' PHE . 40.0 ttm-85 70.02 104.0 0.06 Allowed 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.303 0.573 . . . . 0.0 110.605 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.51 132.64 1.45 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.789 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.655 ' HE1' HG21 ' A' ' 58' ' ' VAL . 24.2 ttt -57.29 148.05 23.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.029 -0.586 . . . . 0.0 111.816 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 79.5 p -166.56 -146.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.533 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.9 mp0 -58.31 -29.93 66.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.318 . . . . 0.0 111.023 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -58.42 -50.73 72.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.014 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.564 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 29.0 tt0 -82.12 -44.69 16.17 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.655 HG21 ' HE1' ' A' ' 53' ' ' MET . 88.2 t -53.04 -44.9 52.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.171 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.593 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 18.0 t80 -61.92 -34.21 75.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.907 0.384 . . . . 0.0 110.688 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.9 m -66.06 -56.68 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.14 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.7 ' HB2' HG22 ' A' ' 34' ' ' ILE . 58.7 mm-40 -58.6 -44.93 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.629 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 58' ' ' VAL . 99.6 t -64.05 -42.47 95.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.736 0.303 . . . . 0.0 110.406 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.55 97.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.226 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -58.63 -41.72 86.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.039 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.61 HD13 HD13 ' A' ' 34' ' ' ILE . 4.8 mt -63.37 -60.18 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.555 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -73.52 39.17 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.957 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 67' ' ' ARG . 52.2 ttp85 -61.63 128.92 38.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.789 0.328 . . . . 0.0 110.42 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.19 -41.78 2.67 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.283 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -83.96 57.87 4.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.93 0.395 . . . . 0.0 110.998 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -63.65 -3.3 2.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.51 -54.98 36.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.925 0.393 . . . . 0.0 110.686 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 49.9 mt -68.62 -42.78 77.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.509 0.671 . . . . 0.0 109.933 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 tp -51.97 -38.14 55.57 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.206 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.408 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 39.3 t -55.73 -42.83 75.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 46.4 mt-10 -63.98 -45.29 89.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.292 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.593 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.3 t80 -57.54 -44.37 85.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.524 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.4 -28.94 70.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.785 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 74' ' ' SER . 97.9 mm-40 -49.93 -46.56 52.21 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.731 0.301 . . . . 0.0 111.27 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -71.33 -43.63 66.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HA ' HD21 ' A' ' 80' ' ' LEU . 50.8 mt -63.28 142.04 97.8 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.169 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.28 -162.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.462 2.108 . . . . 0.0 112.179 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 60.37 56.63 3.12 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 121.02 0.438 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.512 ' HB3' ' H ' ' A' ' 84' ' ' LYS . . . -65.82 -135.2 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.586 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.512 ' H ' ' HB3' ' A' ' 83' ' ' ALA . 0.0 OUTLIER -54.35 -36.37 63.74 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 120.65 0.262 . . . . 0.0 111.207 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.746 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.562 HD21 ' N ' ' B' ' 1' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.828 0.347 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 35' ' ' LEU . 45.5 mm 73.28 -45.4 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.516 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -33.91 77.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.073 0.464 . . . . 0.0 109.779 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.3 ttm -62.62 -49.01 76.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.634 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 79.3 mt -68.9 -46.05 69.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.48 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.522 HD23 ' HA ' ' A' ' 36' ' ' HIS . 45.5 tp -56.22 -39.88 73.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.07 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.62 -39.73 77.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.237 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.71 -39.47 71.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.112 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.24 -46.49 79.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.369 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -60.48 -39.2 86.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.669 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.83 -54.82 42.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.422 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.99 -47.08 78.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.116 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.971 -179.77 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.818 0.342 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 t -60.89 -45.46 94.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.777 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.471 ' CG ' ' H ' ' A' ' 4' ' ' SER . 48.1 t0 -172.12 -137.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.847 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.471 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 25.9 t -74.94 152.26 38.82 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.22 0.533 . . . . 0.0 110.908 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.567 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 83.7 t -61.0 -34.71 60.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.594 178.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.52 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 92.2 mt-10 -61.25 -39.44 90.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.015 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.491 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.2 t80 -63.33 -53.03 59.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -62.68 -32.17 73.19 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.567 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.0 t-20 -59.38 -41.28 88.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.543 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.07 -40.84 68.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.438 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 7' ' ' PHE . 43.5 mm -54.27 -42.04 55.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 CA-C-O 120.964 0.411 . . . . 0.0 110.299 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.1 m -56.75 -38.17 72.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.586 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 15.5 t80 -68.43 -55.31 12.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.948 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.9 -44.24 90.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.126 0.489 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -60.18 -55.39 34.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.813 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.732 ' HZ1' HD22 ' A' ' 72' ' ' LEU . 65.6 tttm -56.42 -40.94 75.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.883 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.3 mt -60.49 -47.77 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.904 0.383 . . . . 0.0 110.64 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.483 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 38.7 ttpt -62.85 -56.68 15.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.751 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.687 HG23 ' HA ' ' A' ' 16' ' ' LYS . 13.0 t -57.29 -29.64 64.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.179 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.481 ' N ' HG21 ' A' ' 19' ' ' THR . 18.2 tpp180 -70.01 -55.65 9.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.768 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.481 ' CD2' HG13 ' A' ' 27' ' ' ILE . 57.2 m-85 -91.19 38.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.904 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' THR . 67.5 mt -52.8 -34.47 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.913 0.387 . . . . 0.0 110.675 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.31 -38.99 60.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -106.27 78.25 0.5 Allowed Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.234 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.98 -34.81 94.8 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.671 2.247 . . . . 0.0 112.458 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.0 -31.26 17.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.022 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.481 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.8 mm -64.33 -47.57 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 18' ' ' LYS . 62.0 t80 -58.51 -45.77 88.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.2 mmt-85 -60.01 -56.51 20.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.611 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.573 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -51.08 -49.14 61.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.988 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.514 ' HA ' HD13 ' A' ' 34' ' ' ILE . 51.8 t80 -51.23 -50.37 59.27 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.703 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 90.1 mt -60.22 -39.75 87.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.681 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.51 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.227 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.812 HG22 ' HB2' ' A' ' 61' ' ' GLU . 85.3 mt -61.47 -56.85 15.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.119 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 mt -60.7 -38.08 83.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.233 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 1.5 m-70 -62.26 -38.39 89.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.225 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 93.3 m -64.24 -45.57 87.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.079 0.466 . . . . 0.0 110.648 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.469 ' CA ' ' HE1' ' A' ' 53' ' ' MET . 33.9 t80 -63.81 -46.81 83.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.936 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.42 -47.07 71.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.224 -178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.466 ' HA ' HD13 ' A' ' 43' ' ' LEU . 16.3 ttpp -52.87 -44.16 66.64 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.827 0.346 . . . . 0.0 111.032 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -42.02 94.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.417 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.554 ' O ' HG21 ' A' ' 45' ' ' THR . 8.4 tt0 -58.36 -28.65 65.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.871 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 40' ' ' LYS . 88.2 mt -61.53 -37.39 83.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -86.81 -30.55 21.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.716 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.554 HG21 ' O ' ' A' ' 42' ' ' GLN . 50.9 p 52.86 45.0 29.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.577 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -149.38 43.35 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.044 0.449 . . . . 0.0 110.713 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.4 141.06 33.19 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.412 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 48' ' ' ARG . 50.0 mtp85 -50.83 143.01 15.74 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.409 -0.396 . . . . 0.0 111.14 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -60.45 134.28 54.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.721 2.281 . . . . 0.0 112.263 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.8 t80 65.82 144.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.784 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 52.54 33.99 14.58 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.61 -122.08 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.061 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.469 ' HE1' ' CA ' ' A' ' 38' ' ' TYR . 18.0 tpt -157.17 122.37 4.57 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.885 0.374 . . . . 0.0 110.768 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 72.7 m -156.69 -150.38 0.28 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.608 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -69.62 -32.94 71.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.067 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -57.08 -47.63 80.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.786 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HG2' ' SD ' ' A' ' 53' ' ' MET . 4.5 tp10 -68.98 -51.75 36.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.685 0.279 . . . . 0.0 111.275 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 43.2 t -53.14 -44.05 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.216 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.582 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 35.3 t80 -60.15 -37.09 79.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.1 m -73.29 -48.06 37.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.812 ' HB2' HG22 ' A' ' 34' ' ' ILE . 4.7 mm-40 -56.82 -46.6 81.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.705 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.4 t -64.69 -42.35 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.024 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.723 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -59.29 -41.05 88.05 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 109.959 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -61.36 -40.09 93.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.532 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.27 -63.94 0.96 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.764 ' HB2' HD21 ' A' ' 73' ' ' LEU . 4.5 m-30 -74.85 42.76 0.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.793 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -62.16 137.92 58.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.01 -45.01 2.69 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.016 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.435 ' C ' ' H ' ' A' ' 71' ' ' ASP . 4.8 pt20 -95.56 51.83 1.32 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.143 0.496 . . . . 0.0 110.277 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -66.96 7.32 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.97 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.4 t70 -61.42 -45.09 95.78 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.732 HD22 ' HZ1' ' A' ' 16' ' ' LYS . 41.9 mt -69.12 -36.15 77.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.077 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.764 HD21 ' HB2' ' A' ' 66' ' ' PHE . 0.1 OUTLIER -54.91 -40.27 69.67 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.705 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.8 t -56.04 -40.66 73.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.474 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -66.96 -38.47 86.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.064 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.586 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.4 t80 -57.5 -45.55 84.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.779 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.25 -34.85 75.49 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.276 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.905 0.383 . . . . 0.0 110.795 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -72.08 -44.96 62.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.698 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.441 HD13 ' CE2' ' A' ' 76' ' ' PHE . 91.0 mt -59.56 140.36 88.94 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.969 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.78 127.84 20.63 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.544 2.163 . . . . 0.0 112.512 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -85.87 57.87 4.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -155.29 53.85 0.62 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.5 -147.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.819 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.89 179.939 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.939 0.399 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mm -64.14 -36.35 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.034 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -32.06 63.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.363 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.24 -45.75 91.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.086 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.64 -46.21 69.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.058 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.72 -46.27 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -68.08 -37.26 81.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.552 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.14 89.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.607 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.32 -43.16 96.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.395 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.14 -48.34 82.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 110.742 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -61.57 -56.58 18.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.387 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 22.5 tp -56.01 -48.59 75.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.752 -178.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.928 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.335 0.112 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t 61.63 -82.83 0.02 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.175 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -66.3 126.78 29.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.873 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -68.94 145.95 53.2 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.078 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 86.0 t -59.57 -39.6 79.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.962 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 90.8 mt-10 -57.35 -34.74 69.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.846 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.511 ' O ' HG12 ' A' ' 11' ' ' ILE . 16.7 t80 -60.69 -60.33 3.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.294 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -62.03 -31.28 71.67 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 39.0 t-20 -57.43 -43.56 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.802 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.11 68.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.834 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 7' ' ' PHE . 46.7 mm -54.42 -44.93 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.096 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.9 p -58.5 -33.51 69.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.835 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.578 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 34.1 t80 -63.0 -53.26 56.8 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.678 HG22 ' HB3' ' B' ' 8' ' ' ALA . 45.3 t -63.77 -40.06 87.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.929 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.14 -45.5 93.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.136 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.634 ' HA ' HG23 ' A' ' 19' ' ' THR . 87.2 tttt -65.57 -39.35 91.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.541 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.0 mt -60.93 -41.17 87.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.511 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.47 ' HZ3' ' HB3' ' B' ' 12' ' ' LEU . 40.8 ttmt -65.5 -56.18 13.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.602 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.634 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.7 t -60.08 -29.13 68.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.472 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -66.55 -55.37 15.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.918 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.679 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 51.1 m-85 -97.2 45.73 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.022 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.27 -43.31 64.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.87 0.367 . . . . 0.0 110.933 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.08 -22.03 45.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.624 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.679 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.9 m170 -109.69 72.19 0.58 Allowed Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.482 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -66.05 -34.85 36.3 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.495 2.13 . . . . 0.0 112.379 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -52.28 -34.49 46.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.412 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.59 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.29 -45.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.127 0.489 . . . . 0.0 110.423 -179.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -53.44 -49.45 67.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.327 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -60.09 -54.61 43.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.759 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.501 ' O ' HG13 ' A' ' 34' ' ' ILE . 36.1 t -51.56 -49.94 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.232 -179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -53.52 -50.18 65.98 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.907 0.384 . . . . 0.0 110.94 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 96.0 mt -59.18 -37.3 77.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -62.41 -35.97 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.942 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.666 HG22 ' HB3' ' A' ' 61' ' ' GLU . 56.8 mt -61.69 -56.91 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.142 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD12 HD11 ' B' ' 5' ' ' LEU . 89.0 mt -57.86 -39.13 77.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.345 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -62.2 -40.05 94.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.872 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.583 HG23 ' HE2' ' A' ' 53' ' ' MET . 99.8 m -60.49 -40.17 90.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.228 0.537 . . . . 0.0 110.155 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.621 ' HB2' HG23 ' A' ' 58' ' ' VAL . 52.2 t80 -63.68 -60.82 2.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.516 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -58.56 -43.94 89.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.632 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.612 ' HZ2' ' HB3' ' A' ' 40' ' ' LYS . 3.0 ttpm? -51.02 -52.53 42.08 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -71.72 -37.37 70.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.812 0.339 . . . . 0.0 111.351 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -51.05 -41.82 60.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.252 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.445 ' HA ' HD21 ' A' ' 43' ' ' LEU . 92.4 mt -60.0 -85.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.831 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -179.99 34.89 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.942 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.4 p -79.2 -140.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.363 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -66.06 148.2 52.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.882 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.84 131.76 1.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.665 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 mtt85 -70.82 134.03 86.11 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.637 0.256 . . . . 0.0 111.33 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.485 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 54.9 Cg_endo -67.88 -156.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.598 2.199 . . . . 0.0 111.87 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.485 ' HB3' ' O ' ' A' ' 49' ' ' PRO . 22.9 t80 71.85 62.68 0.14 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.096 0.474 . . . . 0.0 110.9 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HB3' ' O ' ' A' ' 50' ' ' PHE . 48.1 ttt-85 72.1 110.08 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.015 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -162.32 -38.63 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.21 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.09 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.583 ' HE2' HG23 ' A' ' 37' ' ' THR . 28.0 ttt -161.66 145.9 12.88 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.431 -0.385 . . . . 0.0 110.831 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.484 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 75.0 p -164.65 -143.76 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.504 ' HG3' HD23 ' A' ' 80' ' ' LEU . 8.6 mp0 -64.26 -28.87 70.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.728 0.299 . . . . 0.0 111.192 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -54.25 -46.95 72.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.791 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -81.42 -52.32 7.39 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 38' ' ' TYR . 39.2 t -52.3 -47.38 45.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.689 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.561 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.1 t80 -59.89 -35.34 74.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.5 m -75.35 -52.74 10.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.021 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.666 ' HB3' HG22 ' A' ' 34' ' ' ILE . 4.3 tp10 -57.1 -43.96 82.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.692 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 58' ' ' VAL . 72.9 t -64.87 -45.25 95.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.246 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.08 86.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.21 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.99 -39.91 83.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.196 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.505 HD21 HG21 ' A' ' 27' ' ' ILE . 4.9 mt -69.18 -61.84 1.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.578 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.412 ' CZ ' HG22 ' A' ' 17' ' ' ILE . 4.2 m-30 -73.73 38.38 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.649 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 65' ' ' LEU . 39.9 ttm180 -58.59 133.76 56.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.61 -42.0 3.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.881 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.464 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.5 OUTLIER -77.91 52.3 1.04 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.871 0.367 . . . . 0.0 110.773 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -58.75 -15.26 11.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.65 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.47 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.6 p30 -60.92 -40.12 91.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.581 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.473 HD11 HG12 ' A' ' 17' ' ' ILE . 97.6 mt -72.12 -40.77 67.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.001 0.429 . . . . 0.0 110.364 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -57.47 -33.64 68.19 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.062 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.526 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 35.3 t -58.14 -40.47 81.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.247 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -72.59 -44.73 61.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.522 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.578 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 11.8 t80 -57.23 -40.43 77.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.802 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.41 -34.14 86.95 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.079 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 74' ' ' SER . 86.3 mt-30 -49.66 -51.72 35.93 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.711 0.291 . . . . 0.0 111.469 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.525 ' HB3' ' OD1' ' B' ' 1' ' ' ASN . 3.2 m-85 -69.28 -44.81 71.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.201 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.504 HD23 ' HG3' ' A' ' 55' ' ' GLU . 82.0 mt -62.88 135.77 96.18 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.621 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.495 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 96.1 Cg_endo -78.33 58.88 6.86 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.831 2.354 . . . . 0.0 112.252 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -48.95 132.18 18.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.937 0.399 . . . . 0.0 111.308 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -109.66 -49.22 3.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -152.6 134.55 14.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.778 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.53 ' HD3' ' N ' ' A' ' 85' ' ' ARG . 1.2 mpp_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.775 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.525 ' OD1' ' HB3' ' A' ' 79' ' ' PHE . 19.6 p30 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 121.133 0.492 . . . . 0.0 111.451 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.475 HD13 HD22 ' A' ' 80' ' ' LEU . 50.3 mm -75.12 -27.58 19.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -50.73 -37.53 42.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.604 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 59.6 mtt -58.56 -39.35 80.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.015 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.518 HD11 HD12 ' A' ' 35' ' ' LEU . 20.3 mt -71.7 -46.59 58.27 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.463 ' CD2' HG21 ' B' ' 2' ' ' ILE . 4.1 mm? -57.03 -42.51 80.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.518 0.675 . . . . 0.0 109.406 178.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -69.43 -36.51 76.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.856 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.678 ' HB3' HG22 ' A' ' 14' ' ' VAL . . . -61.32 -44.91 96.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.591 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.452 ' HA ' HG13 ' A' ' 14' ' ' VAL . . . -55.61 -41.73 73.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.876 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.87 -38.82 89.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.661 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.511 ' CD2' HD13 ' A' ' 11' ' ' ILE . 50.4 t80 -56.47 -54.0 50.81 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.972 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.47 ' HB3' ' HZ3' ' A' ' 18' ' ' LYS . 95.9 mt -67.36 -43.48 81.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.539 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.119 179.617 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.649 0.261 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.1 p -174.62 132.7 0.36 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.5 p-10 -173.69 -134.85 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.795 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.9 140.75 55.01 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.196 0.522 . . . . 0.0 111.188 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.3 t -63.76 -41.86 94.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.285 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 46.7 mt-10 -56.63 -36.76 69.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.63 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.463 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.8 t80 -59.15 -57.01 14.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.702 0.287 . . . . 0.0 110.519 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -33.11 75.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.42 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.6 t-20 -55.45 -41.01 72.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.651 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.92 -41.22 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.934 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 7' ' ' PHE . 31.5 mm -50.91 -44.25 26.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.614 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 t -53.94 -41.61 67.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.506 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.512 ' O ' HG13 ' A' ' 17' ' ' ILE . 29.2 t80 -65.77 -56.61 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.829 0.347 . . . . 0.0 111.088 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' B' ' 9' ' ' ALA . 48.7 t -58.26 -43.49 86.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.341 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -58.07 -55.4 35.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.885 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.57 ' HA ' HG23 ' A' ' 19' ' ' THR . 87.6 tttt -53.63 -38.97 64.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.4 mt -61.23 -43.14 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.557 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -65.03 -56.46 12.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.751 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.57 HG23 ' HA ' ' A' ' 16' ' ' LYS . 12.2 t -59.53 -31.62 69.57 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.818 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.5 tpt85 -68.78 -56.93 6.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.92 0.391 . . . . 0.0 111.359 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.469 ' CD2' HG13 ' A' ' 27' ' ' ILE . 70.9 m-85 -93.43 38.94 1.05 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.209 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 19' ' ' THR . 75.8 mt -53.94 -35.22 61.5 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 110.837 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -75.13 -38.9 60.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.888 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -106.33 79.82 0.64 Allowed Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.521 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 24.1 Cg_endo -58.84 -37.72 92.32 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.901 2.401 . . . . 0.0 112.651 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -48.58 -33.74 10.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.218 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.469 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.2 mm -64.43 -48.91 83.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.782 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.489 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.0 t80 -57.54 -50.84 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.87 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.521 ' HD3' ' O ' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -56.21 -51.58 67.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.37 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.516 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.5 m -50.27 -50.5 50.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.071 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.449 ' HA ' HD11 ' A' ' 34' ' ' ILE . 57.2 t80 -53.35 -47.03 69.74 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.159 0.504 . . . . 0.0 110.611 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.3 mt -59.91 -42.69 94.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.354 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.532 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -61.55 -31.69 71.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.015 178.75 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 30' ' ' SER . 78.0 mt -60.63 -58.19 8.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.42 . . . . 0.0 109.935 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.585 ' HB2' HD11 ' B' ' 6' ' ' LEU . 89.5 mt -60.33 -38.57 84.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.546 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 11.3 m-70 -58.98 -40.81 85.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.707 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.9 m -60.71 -36.3 78.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.075 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 50.2 t80 -60.88 -57.89 10.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.076 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.556 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.3 mm100 -62.22 -40.67 96.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.64 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.546 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 67.6 mttm -48.44 -52.82 20.35 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HA ' ' OG1' ' A' ' 45' ' ' THR . 50.3 mt-10 -64.07 -39.83 94.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.665 0.269 . . . . 0.0 111.218 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.882 ' HA ' ' HB3' ' A' ' 49' ' ' PRO . 8.3 tt0 -64.48 -31.78 73.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.1 mt -56.59 -79.94 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.537 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -176.15 42.49 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.0 111.389 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.415 ' OG1' ' HA ' ' A' ' 41' ' ' GLU . 42.9 p -69.39 -126.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.15 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -44.32 -38.3 3.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.357 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.08 -143.67 4.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.916 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.433 HH11 ' HG3' ' A' ' 48' ' ' ARG . 51.2 mtm-85 -75.83 144.98 77.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.708 0.289 . . . . 0.0 111.495 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.882 ' HB3' ' HA ' ' A' ' 42' ' ' GLN . 19.5 Cg_endo -59.87 -175.9 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.749 2.299 . . . . 0.0 112.528 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.494 ' HB2' ' O ' ' A' ' 49' ' ' PRO . 4.3 m-85 66.62 154.75 0.09 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.657 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 53.75 53.21 11.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.278 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.43 -40.04 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.201 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.908 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.9 ttt -167.42 139.53 3.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.7 m -150.08 -146.13 0.19 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.562 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.455 ' N ' ' OE1' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -70.76 -28.53 64.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 0.0 110.98 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.5 pt-20 -57.13 -50.88 71.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.019 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.418 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 5.0 tp10 -66.99 -50.12 63.22 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.639 0.257 . . . . 0.0 111.291 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.497 HG12 HG23 ' A' ' 34' ' ' ILE . 61.1 t -53.35 -41.43 44.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.744 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.574 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 16.7 t80 -60.83 -39.13 87.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.8 m -70.94 -47.92 56.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.719 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 5.1 mm-40 -57.7 -46.96 83.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.41 HG23 ' CE1' ' A' ' 31' ' ' PHE . 68.6 t -64.3 -41.26 91.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.911 0.386 . . . . 0.0 110.0 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.741 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.78 -39.96 93.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.105 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -60.48 -41.19 93.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.217 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.75 -64.27 0.89 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.361 0.601 . . . . 0.0 110.669 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.437 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.6 m-30 -76.31 42.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.138 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -57.86 134.22 56.12 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.452 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.94 -41.44 2.39 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.257 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -79.52 59.95 3.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.901 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.429 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -61.51 -6.05 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.113 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.598 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.0 p30 -61.5 -44.32 97.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.424 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.598 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 98.3 mt -72.62 -40.81 66.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.168 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.741 HD22 ' HA ' ' A' ' 63' ' ' ALA . 1.0 OUTLIER -56.31 -35.83 68.0 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.206 179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 t -58.82 -39.94 82.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.468 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 4.7 mm-40 -70.57 -51.36 28.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.106 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 17.9 t80 -57.53 -39.6 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.133 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.48 -36.43 84.54 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.638 -0.71 . . . . 0.0 113.385 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.7 -45.93 77.75 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.915 0.357 . . . . 0.0 111.66 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -61.9 -47.9 82.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.995 0.426 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.726 HD22 HD12 ' B' ' 2' ' ' ILE . 25.2 mt -72.83 155.15 90.91 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.827 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.28 142.92 35.35 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.489 2.126 . . . . 0.0 111.86 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -46.36 -45.67 17.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.701 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -173.49 -137.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.981 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -149.14 -148.4 0.26 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.659 0.266 . . . . 0.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.012 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.76 0.314 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.726 HD12 HD22 ' A' ' 80' ' ' LEU . 41.2 mm -58.96 -37.69 68.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.785 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -54.65 -47.06 74.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.04 179.644 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 61.6 mtt -59.18 -49.5 77.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.981 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.44 -48.06 82.88 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.938 0.399 . . . . 0.0 111.021 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.585 HD11 ' HB2' ' A' ' 35' ' ' LEU . 48.5 tp -61.5 -38.15 86.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 3' ' ' GLN . 4.1 tm-20 -67.18 -39.15 86.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.089 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.58 61.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.786 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 14' ' ' VAL . . . -57.08 -43.28 81.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -62.12 -40.61 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.644 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -59.09 -53.53 57.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.637 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.3 mt -64.62 -49.91 69.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.179 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.829 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.7 m 64.4 130.09 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.353 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -175.95 44.57 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.508 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.2 t -63.48 148.0 49.8 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.66 0.743 . . . . 0.0 112.52 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.588 ' HA ' ' ND2' ' A' ' 8' ' ' ASN . 71.0 t -56.35 -36.51 47.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.305 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -56.39 -38.0 70.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.089 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.57 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.4 t80 -65.42 -52.86 50.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.779 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.588 ' ND2' ' HA ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -65.22 -32.96 74.89 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.193 0.521 . . . . 0.0 110.32 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 2.6 t-20 -61.57 -41.01 96.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.543 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.99 -41.66 77.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 7' ' ' PHE . 42.6 mm -54.8 -40.52 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.226 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.0 m -55.13 -39.66 69.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.452 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.579 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.0 t80 -68.73 -55.5 11.15 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.969 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.445 ' HB ' HD13 ' B' ' 12' ' ' LEU . 21.5 t -59.35 -37.26 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.938 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -64.03 -56.53 14.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.71 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.565 ' O ' HG21 ' A' ' 19' ' ' THR . 87.6 tttt -53.74 -40.12 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.504 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.1 mt -62.37 -45.74 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HZ2' HD11 ' B' ' 12' ' ' LEU . 3.6 ttmp? -63.01 -55.87 21.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.565 HG21 ' O ' ' A' ' 16' ' ' LYS . 11.8 t -58.8 -32.59 69.49 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.472 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -68.31 -57.36 6.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.375 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -91.62 37.38 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 43.6 mt -56.54 -33.2 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.847 0.356 . . . . 0.0 110.729 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -74.71 -36.95 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.657 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.37 78.9 0.56 Allowed Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.797 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.44 -37.89 95.96 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.886 2.391 . . . . 0.0 112.677 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.95 -33.43 17.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.295 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.406 ' H ' HG12 ' A' ' 27' ' ' ILE . 5.5 mm -64.49 -53.5 41.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.019 0.438 . . . . 0.0 110.814 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.499 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 45.1 t80 -60.5 -49.44 77.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.934 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 29' ' ' ARG . 50.2 mmt-85 -52.67 -52.68 54.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.182 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.613 ' O ' HG13 ' A' ' 34' ' ' ILE . 61.9 m -53.83 -49.32 68.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.977 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.461 ' O ' ' HB ' ' A' ' 34' ' ' ILE . 62.0 t80 -51.65 -50.29 60.64 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.926 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 36.1 mt -57.82 -44.73 86.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.117 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 95.2 mt-10 -62.68 -30.04 71.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.618 HD13 HD13 ' A' ' 65' ' ' LEU . 76.9 mt -60.95 -56.49 17.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.944 0.402 . . . . 0.0 110.241 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.517 ' HB2' HD11 ' B' ' 6' ' ' LEU . 49.5 mt -64.53 -41.72 96.19 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.621 0.724 . . . . 0.0 109.17 178.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.739 ' HB3' ' HZ1' ' A' ' 40' ' ' LYS . 11.8 m-70 -55.84 -41.61 74.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.954 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 70.1 m -59.74 -36.43 76.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.384 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.491 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 62.0 t80 -60.84 -59.66 5.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.021 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -63.02 -36.6 84.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.096 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.739 ' HZ1' ' HB3' ' A' ' 36' ' ' HIS . 51.6 mttp -47.06 -35.51 6.98 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.85 -42.76 99.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.688 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.59 ' H ' HE21 ' A' ' 42' ' ' GLN . 0.1 OUTLIER -83.58 -50.2 8.46 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.64 13.18 0.39 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.62 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 95.8 m-70 -154.14 40.26 0.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.84 0.352 . . . . 0.0 111.171 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.6 p -62.59 134.14 55.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.829 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 46' ' ' LYS . 14.6 tptm -172.55 -50.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.058 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.31 33.49 0.04 OUTLIER Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.453 -0.88 . . . . 0.0 112.978 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.461 HH11 ' HG3' ' A' ' 48' ' ' ARG . 52.6 mtt85 -75.52 142.1 73.84 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.661 0.267 . . . . 0.0 111.009 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.424 ' HB2' ' HG3' ' A' ' 51' ' ' ARG . 14.6 Cg_endo -57.09 129.77 36.12 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.618 2.212 . . . . 0.0 112.345 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.477 ' C ' ' H ' ' A' ' 52' ' ' GLY . 4.6 m-85 -81.25 52.83 1.9 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.403 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.424 ' HG3' ' HB2' ' A' ' 49' ' ' PRO . 89.0 mtm180 -76.86 31.19 0.13 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.227 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . 65.03 135.89 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 115.946 -0.57 . . . . 0.0 113.182 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.447 ' HE2' HG21 ' A' ' 58' ' ' VAL . 15.5 tpt -169.0 126.82 0.99 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 120.837 0.351 . . . . 0.0 110.879 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.491 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.1 t -176.95 -138.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.129 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -33.82 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.026 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 22.5 pt-20 -59.85 -51.34 70.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 39.4 tp10 -67.84 -52.07 41.12 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.162 -0.215 . . . . 0.0 111.405 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.567 HG11 HG23 ' A' ' 34' ' ' ILE . 88.8 t -53.4 -42.56 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.061 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.602 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 23.4 t80 -63.6 -38.94 93.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 89.6 m -68.47 -48.72 63.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.838 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -57.28 -45.87 83.65 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.825 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.446 HG21 HG22 ' A' ' 34' ' ' ILE . 64.8 t -64.58 -40.78 90.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.742 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -60.85 -39.89 90.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.039 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -64.44 -41.04 96.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.661 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 34' ' ' ILE . 5.3 mt -64.04 -64.16 0.96 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.268 0.556 . . . . 0.0 111.298 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.57 ' HB2' HD22 ' A' ' 73' ' ' LEU . 6.2 m-30 -74.48 40.25 0.13 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.768 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -59.0 131.57 51.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 110.296 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.23 -43.38 2.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.966 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -86.03 52.62 2.53 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.937 0.399 . . . . 0.0 110.525 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 94.9 mt-10 -64.6 0.88 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.013 -179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -61.49 -47.98 83.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.077 0.465 . . . . 0.0 109.96 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.06 -33.64 68.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.966 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.742 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.74 -43.23 68.93 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.676 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.493 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 38.8 t -54.36 -40.49 68.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.696 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 49.4 mt-10 -63.35 -46.32 87.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.451 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.602 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 13.4 t80 -57.72 -44.68 86.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.54 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.73 -29.64 72.69 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.047 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 74' ' ' SER . 11.5 mm100 -47.73 -51.19 23.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.737 0.303 . . . . 0.0 111.483 -179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -69.16 -43.16 74.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.528 HD22 HD13 ' B' ' 2' ' ' ILE . 53.1 mt -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.049 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.411 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 13.8 Cg_exo -68.02 123.71 10.96 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.471 2.114 . . . . 0.0 111.82 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 81' ' ' PRO . 88.5 tt0 178.74 64.12 0.01 OUTLIER 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.876 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.34 -44.88 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.434 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -59.59 -41.14 89.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.024 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.742 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 5.0 m120 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.921 0.391 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.528 HD13 HD22 ' A' ' 80' ' ' LEU . 40.2 mm -61.27 -39.87 84.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.165 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -35.05 62.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.655 0.264 . . . . 0.0 110.61 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 95.8 mmm -69.42 -45.82 68.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.649 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.544 HD12 ' HD2' ' A' ' 13' ' ' TYR . 20.2 tp -64.03 -49.2 73.33 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.936 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 35' ' ' LEU . 28.5 tp -59.86 -40.39 88.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.022 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -63.88 -37.3 86.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' B' ' 5' ' ' LEU . . . -54.6 -41.5 70.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.923 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.22 81.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.72 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -59.03 -38.44 79.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.176 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.459 ' CD2' HD13 ' A' ' 11' ' ' ILE . 66.6 t80 -63.42 -44.47 94.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.671 HD11 ' HZ2' ' A' ' 18' ' ' LYS . 84.6 mt -75.86 24.7 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.715 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.444 ' H ' ' C ' ' B' ' 11' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.183 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.836 0.35 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -62.43 -48.86 77.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.052 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -175.2 42.43 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.998 0.428 . . . . 0.0 110.632 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -62.79 143.62 57.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.128 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 99.1 t -60.69 -39.58 82.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.051 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.431 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 47.6 mt-10 -54.13 -34.88 61.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.12 0.486 . . . . 0.0 109.783 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.556 ' O ' HG12 ' A' ' 11' ' ' ILE . 15.2 t80 -68.41 -56.04 9.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.981 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -62.86 -28.4 70.0 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.917 0.865 . . . . 0.0 108.953 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.1 t-20 -58.66 -46.05 88.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.041 -1.436 . . . . 0.0 109.683 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.19 -36.94 72.12 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.318 179.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 7' ' ' PHE . 49.4 mm -52.57 -41.89 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.92 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.0 t -58.7 -37.64 76.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.191 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.622 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -63.26 -54.15 41.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.25 0.547 . . . . 0.0 109.741 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' B' ' 9' ' ' ALA . 53.1 t -60.36 -38.94 79.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.85 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.401 ' HB2' HD12 ' B' ' 12' ' ' LEU . 19.2 t-20 -63.6 -47.28 82.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.391 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.623 ' HA ' HG23 ' A' ' 19' ' ' THR . 23.5 ttmm -63.28 -36.14 82.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.563 HG12 HD12 ' A' ' 72' ' ' LEU . 81.2 mt -64.66 -42.55 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.823 0.344 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.459 ' O ' HD22 ' A' ' 22' ' ' LEU . 28.7 mtpp -62.29 -46.6 88.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 110.783 179.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.623 HG23 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -71.27 -29.45 65.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.529 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.433 ' N ' HG21 ' A' ' 19' ' ' THR . 18.9 tpp180 -67.14 -56.02 11.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.278 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CD2' HG13 ' A' ' 27' ' ' ILE . 73.1 m-85 -95.48 42.09 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 19' ' ' THR . 77.9 mt -54.97 -36.6 65.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.331 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -75.66 -38.47 58.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.885 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -105.86 78.15 0.45 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.198 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.45 -33.65 93.8 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.75 2.3 . . . . 0.0 112.518 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -53.51 -30.21 40.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 21' ' ' PHE . 6.9 mm -64.19 -51.95 62.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.837 0.351 . . . . 0.0 111.017 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.507 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 62.7 t80 -57.08 -46.1 82.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.823 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.486 HH11 ' HA ' ' A' ' 29' ' ' ARG . 3.8 mmm180 -55.68 -56.11 24.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.618 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.415 ' HB2' HD12 ' A' ' 65' ' ' LEU . 50.9 m -54.64 -49.88 69.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.21 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.559 ' CZ ' HD13 ' A' ' 35' ' ' LEU . 49.4 t80 -49.15 -47.11 45.98 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.027 0.442 . . . . 0.0 110.825 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 90.0 mt -60.09 -40.69 90.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.555 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -63.4 -36.81 84.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.48 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.488 HG22 HG21 ' A' ' 62' ' ' VAL . 75.3 mt -60.07 -56.32 18.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.749 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.559 HD13 ' CZ ' ' A' ' 31' ' ' PHE . 83.4 mt -59.02 -44.41 91.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.326 0.584 . . . . 0.0 109.468 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.558 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -54.96 -42.68 72.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.708 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -55.66 -39.04 70.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.646 ' HB2' HG23 ' A' ' 58' ' ' VAL . 42.2 t80 -65.25 -57.19 9.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.951 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.557 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 3.8 mm100 -52.45 -34.48 48.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.727 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.818 ' HA ' ' HE3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -53.3 -49.88 66.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.266 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -42.66 83.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.332 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.403 ' O ' HG22 ' A' ' 45' ' ' THR . 8.2 tt0 -57.93 -33.38 68.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.54 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.7 mt -56.02 -47.18 78.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.777 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -116.26 53.6 0.86 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.648 -179.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 42' ' ' GLN . 57.8 p -60.41 132.4 53.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.821 0.343 . . . . 0.0 111.349 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.529 ' HD2' ' N ' ' A' ' 46' ' ' LYS . 11.8 mptt -81.11 46.1 0.89 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.721 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.46 -96.88 0.36 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.604 -0.808 . . . . 0.0 112.169 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -59.76 143.61 86.77 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.759 0.314 . . . . 0.0 110.789 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.42 136.32 70.94 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.814 2.343 . . . . 0.0 112.513 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.425 ' C ' ' H ' ' A' ' 52' ' ' GLY . 23.6 t80 -119.94 144.17 47.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' A' ' 51' ' ' ARG . 53.2 mtm-85 -76.34 35.1 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.882 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . -79.94 -46.36 7.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.425 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.69 ' HE1' HG21 ' A' ' 58' ' ' VAL . 26.5 ttt -168.96 147.36 3.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.3 -0.45 . . . . 0.0 110.685 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -162.54 -154.57 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.542 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -62.97 -31.38 72.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.729 0.3 . . . . 0.0 111.076 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.423 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.2 pt-20 -61.3 -51.15 70.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.734 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.423 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 18.4 tt0 -69.04 -45.34 70.67 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.364 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.69 HG21 ' HE1' ' A' ' 53' ' ' MET . 57.5 t -56.91 -44.14 81.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 0.0 110.375 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.7 t80 -64.24 -37.93 89.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.724 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.9 m -65.47 -55.27 18.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.11 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HB2' HG22 ' A' ' 34' ' ' ILE . 59.3 mm-40 -57.54 -46.5 83.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.488 HG21 HG22 ' A' ' 34' ' ' ILE . 85.8 t -64.0 -41.35 92.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.717 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.9 -41.09 95.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.14 0.495 . . . . 0.0 109.931 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -60.08 -44.56 94.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.553 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' A' ' 67' ' ' ARG . 3.1 mt -63.17 -61.56 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.334 0.588 . . . . 0.0 110.605 179.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -72.94 36.94 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.486 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 65' ' ' LEU . 29.5 tpt85 -59.6 129.46 42.03 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -36.14 2.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.371 -0.918 . . . . 0.0 111.553 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 67' ' ' ARG . 7.9 mm-40 -78.28 42.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.836 0.35 . . . . 0.0 110.17 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.615 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 6.3 tt0 -53.99 -11.68 0.48 Allowed 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -60.69 -49.4 77.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.87 0.367 . . . . 0.0 110.074 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.563 HD12 HG12 ' A' ' 17' ' ' ILE . 82.3 mt -72.49 -34.38 67.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.541 . . . . 0.0 110.058 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.717 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -52.04 -42.32 63.02 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.107 -179.652 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 t -56.87 -41.13 77.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.257 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.706 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 90.7 mt-10 -67.99 -46.63 70.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.034 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.622 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.4 t80 -58.35 -41.48 84.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.1 -42.79 99.91 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.421 -0.809 . . . . 0.0 114.069 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.706 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 1.6 pt20 -54.87 -40.93 70.23 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 117.238 0.519 . . . . 0.0 111.211 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -62.17 -46.71 87.74 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 120.991 0.424 . . . . 0.0 110.411 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 73.7 mt -62.93 148.16 92.71 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.657 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.1 143.09 42.68 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.518 2.145 . . . . 0.0 112.128 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -157.0 64.52 0.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.92 0.391 . . . . 0.0 110.991 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 65.11 51.78 1.61 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.5 tttm 64.83 134.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.101 0.477 . . . . 0.0 111.801 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.5 ' HG3' HH11 ' A' ' 85' ' ' ARG . 28.7 tpt85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.757 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.937 0.398 . . . . 0.0 111.304 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 51.4 mm -65.59 -39.53 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -33.85 68.31 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.1 mmt -59.15 -39.44 82.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.1 mt -72.14 -45.77 59.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.526 ' HG ' ' HG3' ' A' ' 39' ' ' GLN . 3.3 mm? -56.8 -42.72 80.01 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.453 0.645 . . . . 0.0 109.265 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.93 -37.19 72.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.154 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.65 -47.19 84.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.03 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.463 ' HA ' HG12 ' A' ' 14' ' ' VAL . . . -55.86 -43.21 76.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.321 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.64 -38.96 89.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.715 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.23 -54.95 33.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.746 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.401 HD12 ' HB2' ' A' ' 15' ' ' ASN . 95.5 mt -62.41 -51.33 67.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.627 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.909 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.724 0.297 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m 56.31 44.15 25.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.789 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -173.78 50.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.467 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p -56.65 147.5 22.43 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.441 0.639 . . . . 0.0 112.106 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 69.7 t -55.33 -39.34 51.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.081 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.421 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.0 mt-10 -59.45 -38.6 81.18 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.139 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.457 ' O ' HG12 ' A' ' 11' ' ' ILE . 20.6 t80 -60.76 -58.22 9.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.429 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -64.29 -28.83 69.99 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.2 t-20 -58.13 -44.06 87.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.347 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.21 -45.43 60.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.188 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 7' ' ' PHE . 40.3 mm -53.35 -45.48 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.261 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -58.29 -35.37 71.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.114 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.623 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 38.7 t80 -63.35 -55.83 21.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.195 0.521 . . . . 0.0 109.815 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.9 t -60.73 -38.02 77.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.453 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.476 ' HB2' HD12 ' B' ' 12' ' ' LEU . 20.8 t-20 -64.57 -41.08 96.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.691 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.63 ' HA ' HG23 ' A' ' 19' ' ' THR . 40.4 ttmt -66.77 -38.72 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.125 0.488 . . . . 0.0 110.121 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.8 mt -62.11 -42.83 96.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.68 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -65.28 -54.78 24.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.641 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.63 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.6 t -59.64 -31.27 69.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.569 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.546 ' N ' HG21 ' A' ' 19' ' ' THR . 17.2 tpp180 -68.11 -52.42 35.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.115 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.599 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 78.2 m-85 -98.3 44.17 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.026 -179.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 85.2 mt -56.39 -42.41 77.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.854 0.359 . . . . 0.0 110.546 179.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -76.21 -23.72 54.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.157 0.503 . . . . 0.0 109.86 179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.599 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.3 m170 -108.99 73.06 0.5 Allowed Pre-proline 0 CA--C 1.535 0.366 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.351 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.39 -34.59 43.2 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.639 2.226 . . . . 0.0 112.46 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -53.91 -35.25 61.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.427 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.566 ' CG1' ' HB3' ' A' ' 24' ' ' HIS . 1.0 OUTLIER -64.29 -51.65 65.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.556 -179.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.554 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 54.9 t80 -56.9 -47.24 81.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.95 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -55.61 -54.6 42.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.277 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 34' ' ' ILE . 44.7 t -54.16 -48.12 71.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.536 ' HA ' HD11 ' A' ' 34' ' ' ILE . 49.0 t80 -52.33 -47.52 65.98 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.99 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.4 mt -60.09 -41.42 92.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.488 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 39.3 tt0 -63.77 -30.02 71.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.693 HG22 ' HB2' ' A' ' 61' ' ' GLU . 79.6 mt -62.47 -56.71 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.124 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.052 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HB2' HD11 ' B' ' 6' ' ' LEU . 78.3 mt -61.82 -36.26 80.64 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.5 0.667 . . . . 0.0 109.232 178.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.569 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 5.1 m-70 -59.95 -48.06 83.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.901 179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.513 HG23 ' SD ' ' A' ' 53' ' ' MET . 99.5 m -60.49 -36.59 78.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.239 179.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.571 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 41.5 t80 -53.95 -57.76 9.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.554 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.6 mm100 -60.9 -42.55 98.24 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.091 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 34.5 mmtp -53.86 -44.48 70.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.367 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.481 ' HG2' ' HB3' ' A' ' 53' ' ' MET . 5.6 tp10 -69.66 -35.99 75.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.649 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.38 -31.42 70.78 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 88.4 mt -71.81 121.97 19.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.427 ' HB3' ' O ' ' A' ' 43' ' ' LEU . 21.3 p80 168.3 135.2 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.262 0.351 . . . . 0.0 111.124 179.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.8 p -118.51 132.79 56.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.697 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 60.23 123.16 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.49 145.15 4.08 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.575 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.39 133.77 62.05 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.533 0.206 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -63.96 148.99 91.51 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.597 2.198 . . . . 0.0 112.297 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.6 166.83 23.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.304 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -45.53 -33.17 2.6 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.214 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 55.89 -132.4 50.32 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.979 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.513 ' SD ' HG23 ' A' ' 37' ' ' THR . 25.2 ttt -167.03 144.51 4.75 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.618 -0.291 . . . . 0.0 110.809 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.443 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 75.6 m -157.81 -145.76 0.15 Allowed 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.231 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.802 ' HG2' ' HD2' ' A' ' 81' ' ' PRO . 9.1 mp0 -60.22 -33.52 72.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.752 0.31 . . . . 0.0 110.999 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -54.04 -44.42 71.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.338 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.437 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 37.2 tp10 -82.21 -51.89 7.5 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.689 HG12 HG23 ' A' ' 34' ' ' ILE . 44.6 t -52.94 -43.11 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.639 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.55 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 40.2 t80 -61.15 -36.88 80.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.875 0.369 . . . . 0.0 110.302 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 88.1 m -71.79 -48.39 46.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.475 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.693 ' HB2' HG22 ' A' ' 34' ' ' ILE . 4.8 mm-40 -56.78 -48.07 78.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.932 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.56 -41.85 93.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.068 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.723 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -59.7 -39.03 83.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.85 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -63.91 -37.98 89.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.347 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 34' ' ' ILE . 5.8 mt -70.56 -66.28 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.512 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.543 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.0 m-30 -74.55 38.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.087 -178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -66.4 138.49 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.549 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.31 -44.53 2.79 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.527 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.55 ' C ' ' H ' ' A' ' 71' ' ' ASP . 0.7 OUTLIER -68.47 -62.95 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.82 0.343 . . . . 0.0 110.573 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.6 mt-10 59.98 -15.94 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.55 ' H ' ' C ' ' A' ' 69' ' ' GLN . 34.4 t70 -61.99 -49.17 77.15 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-O 121.096 0.474 . . . . 0.0 109.897 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.3 mt -68.84 -36.35 78.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.834 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.723 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.59 -39.35 67.74 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.68 179.858 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.578 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 37.4 t -55.44 -41.96 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.738 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.66 -42.77 77.44 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.539 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.623 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 20.1 t80 -57.28 -44.22 83.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.846 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.02 -38.36 95.41 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.59 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 74' ' ' SER . 76.8 mt-30 -54.71 -45.3 74.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.885 0.374 . . . . 0.0 110.906 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -66.85 -44.53 80.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.003 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.495 HD22 HD12 ' B' ' 2' ' ' ILE . 85.8 mt -65.48 131.75 94.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.378 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.802 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 16.2 Cg_exo -66.87 147.78 81.19 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.806 2.338 . . . . 0.0 111.786 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -64.83 -151.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.222 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -177.06 44.87 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.81 0.338 . . . . 0.0 111.196 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -62.08 139.34 58.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.449 ' HD2' ' C ' ' A' ' 85' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.2 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 6.4 m120 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.648 0.261 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.495 HD12 HD22 ' A' ' 80' ' ' LEU . 48.1 mm -52.73 -24.56 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.141 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -55.4 -58.13 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.485 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -79.77 -27.99 40.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.455 HD11 HD12 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -58.87 -45.95 88.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.845 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.599 HD11 ' HB2' ' A' ' 35' ' ' LEU . 43.1 tp -77.77 -44.46 27.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 tp10 -56.52 -33.16 65.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.653 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.95 82.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.357 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' B' ' 13' ' ' GLU . . . -56.47 -47.68 78.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.442 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.98 -38.88 83.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.437 ' CD2' HD13 ' A' ' 11' ' ' ILE . 47.2 t80 -59.53 -54.77 42.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.849 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.476 HD12 ' HB2' ' A' ' 15' ' ' ASN . 89.0 mt -60.87 -48.83 80.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.903 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 12.5 pt-20 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.787 0.327 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p -177.26 -146.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.373 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 63.45 148.51 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.895 0.379 . . . . 0.0 111.482 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -51.17 144.1 9.85 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.123 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.529 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 92.9 t -58.67 -40.71 80.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.386 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 91.7 mt-10 -58.23 -38.96 77.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.585 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.468 ' O ' HG12 ' A' ' 11' ' ' ILE . 13.4 t80 -59.92 -56.58 20.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.747 0.308 . . . . 0.0 110.702 -179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.06 -31.07 72.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.563 0.696 . . . . 0.0 109.153 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.4 t-20 -56.88 -43.15 81.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.661 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.79 77.2 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.278 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 7' ' ' PHE . 42.4 mm -53.79 -42.76 53.7 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.416 179.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 m -55.58 -37.97 68.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.823 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.556 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.9 t80 -64.84 -58.08 7.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.847 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.88 -45.09 91.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.396 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -61.07 -54.58 42.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.042 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.608 ' O ' HG21 ' A' ' 19' ' ' THR . 87.8 tttt -53.64 -37.42 63.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.197 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 13' ' ' TYR . 95.5 mt -64.84 -37.26 79.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.002 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -65.54 -47.59 75.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.426 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.3 t -70.98 -26.99 63.39 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.754 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.462 ' HG2' HD13 ' A' ' 72' ' ' LEU . 19.5 tpp180 -64.77 -58.07 7.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.318 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.773 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 61.6 m-85 -94.89 46.42 1.13 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.427 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.5 mt -55.45 -40.74 71.96 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.811 0.338 . . . . 0.0 110.796 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.38 -19.35 46.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.094 0.473 . . . . 0.0 110.156 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.773 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 58.1 m170 -110.33 74.06 0.82 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.354 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.72 -35.61 56.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.589 2.193 . . . . 0.0 112.55 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -52.17 -36.47 51.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.63 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.46 -48.35 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 110.701 -179.738 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.61 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 55.3 t80 -56.92 -51.36 69.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.118 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.413 ' HG3' HH11 ' A' ' 29' ' ' ARG . 21.5 mmt85 -56.9 -54.29 48.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.493 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.584 ' O ' HG13 ' A' ' 34' ' ' ILE . 57.0 m -52.85 -49.56 65.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.626 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.701 ' HA ' HD13 ' A' ' 34' ' ' ILE . 51.9 t80 -53.54 -49.81 66.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 110.959 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 41.2 mt -58.1 -39.78 79.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.161 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.59 -29.53 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.201 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.701 HD13 ' HA ' ' A' ' 31' ' ' PHE . 82.9 mt -61.75 -59.53 4.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.57 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 86.3 mt -60.3 -38.79 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.645 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 1.1 m-70 -59.74 -42.79 93.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.242 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.413 ' HA ' ' HD2' ' A' ' 40' ' ' LYS . 75.3 m -60.53 -39.12 86.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.464 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 46.6 t80 -55.16 -58.87 5.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.667 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.535 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 11.0 mm100 -55.27 -38.5 68.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.046 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 67.2 mttm -47.3 -42.85 21.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.792 0.329 . . . . 0.0 111.101 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -70.73 -45.72 64.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.106 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.621 ' H ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER -77.75 18.61 0.45 Allowed 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.367 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 71.5 mt -77.76 30.1 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.831 0.348 . . . . 0.0 111.183 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.461 ' H ' ' C ' ' A' ' 42' ' ' GLN . 56.1 m170 -128.15 -128.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.814 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.8 p -145.26 39.31 1.19 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -152.36 145.57 24.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.625 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -149.43 34.07 1.08 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.24 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -80.74 147.44 62.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.672 0.272 . . . . 0.0 110.668 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -56.45 132.09 49.69 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.651 2.234 . . . . 0.0 111.737 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.48 ' C ' ' H ' ' A' ' 52' ' ' GLY . 2.7 t80 -172.52 -166.73 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.284 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.413 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 54.3 ttp180 -71.25 10.58 0.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.148 0.499 . . . . 0.0 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.48 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . -75.38 -126.42 0.19 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.656 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.3 ttt -156.93 149.16 23.05 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.534 -0.333 . . . . 0.0 111.087 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 81.3 p -164.93 -142.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.275 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.83 -30.69 71.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.892 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.5 pt-20 -54.8 -50.18 69.17 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.428 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 5.0 tp10 -72.9 -49.44 29.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.8 t -52.63 -40.68 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.396 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.485 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 22.5 t80 -60.38 -40.22 90.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.561 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.3 m -73.59 -44.8 56.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.407 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.644 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -57.29 -47.77 80.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.232 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.476 HG21 HG23 ' A' ' 34' ' ' ILE . 61.5 t -71.66 -42.93 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.744 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -62.21 -44.81 95.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.134 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.644 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -64.12 -40.87 97.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.87 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.401 ' C ' ' H ' ' A' ' 67' ' ' ARG . 3.2 mt -60.98 -61.0 2.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.829 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.449 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 6.6 m-30 -72.95 38.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.826 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 65' ' ' LEU . 46.2 ttm-85 -60.2 127.88 34.01 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.49 -43.23 2.78 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.802 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.43 49.84 1.88 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.94 0.4 . . . . 0.0 110.453 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.8 mt-10 -60.63 -8.52 2.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.732 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -61.16 -45.68 93.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.93 0.395 . . . . 0.0 109.942 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.462 HD13 ' HG2' ' A' ' 20' ' ' ARG . 94.4 mt -72.15 -32.63 67.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.919 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.744 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.28 -42.53 73.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.738 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 44.3 t -53.79 -39.94 65.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.234 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -68.0 -41.53 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.608 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.556 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 12.4 t80 -56.54 -43.55 79.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.246 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.13 -32.87 83.95 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.26 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 74' ' ' SER . 94.0 mm-40 -56.39 -47.31 79.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.858 0.361 . . . . 0.0 111.001 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.35 -44.55 67.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.169 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.4 HD13 ' CE2' ' A' ' 76' ' ' PHE . 93.7 mt -57.08 126.46 73.45 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.978 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.32 129.69 17.43 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.538 2.159 . . . . 0.0 112.356 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -70.82 132.95 46.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.4 -166.65 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 61.74 134.89 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.421 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.475 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 9.0 mpt_? . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.757 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.903 0.382 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.4 HG21 HD23 ' A' ' 35' ' ' LEU . 37.7 mm -64.4 -34.45 69.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.785 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.64 -35.13 40.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.233 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 24.9 mmt -63.14 -50.39 70.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.591 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.484 HD23 ' HD2' ' A' ' 13' ' ' TYR . 81.9 mt -65.95 -46.91 76.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 41.4 tp -61.17 -47.22 87.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.27 -35.51 80.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.418 . . . . 0.0 110.184 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.57 62.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.917 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.66 -48.27 79.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.134 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.6 -38.73 91.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.629 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.429 ' CD2' HD13 ' A' ' 11' ' ' ILE . 50.6 t80 -57.94 -54.24 49.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.351 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.432 ' HA ' HD21 ' B' ' 12' ' ' LEU . 96.0 mt -64.55 -49.55 70.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.221 -179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.889 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.567 0.222 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.6 m 54.94 44.91 27.52 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.798 0.332 . . . . 0.0 111.041 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 58.17 54.83 5.53 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.741 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 m -51.76 142.49 14.81 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.262 0.553 . . . . 0.0 111.366 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 92.0 t -60.65 -41.92 89.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.549 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 89.4 mt-10 -57.76 -38.47 75.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.642 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.509 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.0 t80 -59.98 -57.43 12.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.889 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -31.28 72.33 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.569 0.699 . . . . 0.0 109.374 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.5 t-20 -55.66 -42.94 75.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.21 -44.42 62.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.981 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 7' ' ' PHE . 44.6 mm -53.15 -43.06 48.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.046 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -57.15 -38.47 73.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.028 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.573 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 25.1 t80 -63.88 -55.97 18.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.088 0.47 . . . . 0.0 110.768 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.9 t -57.1 -45.0 84.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.378 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -57.69 -56.32 23.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.111 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.629 ' HA ' HG23 ' A' ' 19' ' ' THR . 88.2 tttt -52.99 -36.53 60.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.518 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.9 mt -64.19 -41.12 91.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.268 179.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -64.17 -55.48 21.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.507 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.629 HG23 ' HA ' ' A' ' 16' ' ' LYS . 13.3 t -59.22 -31.18 68.81 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.396 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.507 ' N ' HG21 ' A' ' 19' ' ' THR . 10.8 tpt180 -68.11 -56.09 10.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.909 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CE2' HG22 ' A' ' 27' ' ' ILE . 55.8 m-85 -93.98 41.31 1.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.989 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.0 mt -56.96 -35.36 69.03 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.996 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -74.95 -39.95 61.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.021 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -107.74 77.24 0.61 Allowed Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.356 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.99 -33.74 95.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.593 2.195 . . . . 0.0 112.395 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -51.2 -34.11 30.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.595 HG21 HD21 ' A' ' 65' ' ' LEU . 3.8 mm -64.37 -45.99 94.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.167 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.581 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 59.8 t80 -58.82 -49.39 77.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -56.24 -55.49 32.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.466 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.629 ' HG ' HD23 ' A' ' 65' ' ' LEU . 18.5 p -53.02 -49.01 67.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.325 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.649 ' HA ' HD13 ' A' ' 34' ' ' ILE . 47.8 t80 -51.2 -45.25 61.78 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.878 0.37 . . . . 0.0 110.435 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 64.9 mt -62.93 -49.51 74.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -53.65 -29.39 38.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.481 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.649 HD13 ' HA ' ' A' ' 31' ' ' PHE . 84.3 mt -61.26 -49.62 83.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.104 0.478 . . . . 0.0 110.135 179.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HB3' ' A' ' 38' ' ' TYR . 58.2 mt -66.15 -40.97 90.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.58 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -60.26 -38.86 84.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.21 178.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.1 m -60.94 -36.84 80.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.621 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.629 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 78.5 t80 -59.07 -60.3 4.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.012 179.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.518 ' OE1' HD21 ' B' ' 6' ' ' LEU . 2.7 mp0 -52.41 -31.75 35.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 48.4 mmtm -59.69 -75.7 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -81.98 38.04 0.51 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.639 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.529 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 3.0 pt20 -67.27 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.783 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.529 ' N ' ' HG3' ' A' ' 42' ' ' GLN . 0.2 OUTLIER -62.19 -120.26 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.586 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.476 ' H ' ' HB2' ' A' ' 43' ' ' LEU . 24.6 m170 71.41 38.96 0.97 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.432 0.634 . . . . 0.0 109.898 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 p 48.23 -150.28 0.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.681 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 46' ' ' LYS . 12.3 mptt -96.49 151.24 19.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.134 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -159.59 -131.04 1.2 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.424 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.408 HH11 ' HG2' ' A' ' 48' ' ' ARG . 73.2 mtt-85 -56.13 141.95 67.56 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.711 0.291 . . . . 0.0 110.984 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.97 134.1 60.11 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.681 2.254 . . . . 0.0 112.295 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.402 ' C ' ' H ' ' A' ' 52' ' ' GLY . 25.6 t80 -173.9 147.72 1.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.647 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 5.8 tpm_? -58.28 -9.27 1.43 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.145 0.498 . . . . 0.0 111.151 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.402 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . 70.0 135.1 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.75 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.1 ttt -101.06 149.09 24.31 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.418 -0.391 . . . . 0.0 111.164 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.629 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 79.8 p -163.09 -148.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.732 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -68.51 -32.62 72.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.035 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.447 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 11.6 pt-20 -61.78 -48.11 82.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.581 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 -66.85 -47.66 71.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.595 0.236 . . . . 0.0 111.196 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 66.9 t -57.96 -43.15 84.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.984 0.421 . . . . 0.0 110.513 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.624 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.3 t80 -62.86 -39.44 94.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.944 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -66.14 -49.67 66.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.628 ' HB2' HG22 ' A' ' 34' ' ' ILE . 62.6 mm-40 -57.33 -45.29 84.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.016 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.7 t -64.48 -40.83 90.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.054 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.743 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.89 -41.66 98.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.098 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -62.01 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.532 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.629 HD23 ' HG ' ' A' ' 30' ' ' SER . 5.8 mt -67.64 -65.06 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.431 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.507 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 5.9 m-30 -73.43 38.86 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.638 -179.071 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 65' ' ' LEU . 12.1 tpt180 -58.76 132.62 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.23 -43.32 3.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.791 -178.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.8 OUTLIER -79.93 51.23 1.3 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.81 0.338 . . . . 0.0 110.587 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.1 mt-10 -61.72 -4.33 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.051 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.72 -50.61 71.75 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.964 0.411 . . . . 0.0 110.066 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.58 -36.28 73.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.981 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.743 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.92 -40.85 70.29 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.64 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.9 t -56.3 -40.35 74.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.562 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.29 -38.91 71.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.088 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.624 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.6 t80 -57.51 -43.24 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.005 0.431 . . . . 0.0 110.233 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.21 -31.41 78.96 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.364 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -50.63 -48.53 58.05 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.801 0.334 . . . . 0.0 111.018 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -69.86 -43.26 72.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.556 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.43 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 75.5 mt -61.07 131.52 91.97 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.739 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.433 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 Cg_exo -68.92 -171.19 0.38 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.466 2.111 . . . . 0.0 112.087 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 81' ' ' PRO . 39.1 tt0 72.44 -39.9 0.46 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.943 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.412 ' H ' ' C ' ' A' ' 81' ' ' PRO . . . -66.63 -147.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.652 0.263 . . . . 0.0 111.398 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp 63.59 134.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.998 0.428 . . . . 0.0 111.156 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.801 179.995 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.88 -39.33 84.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . 0.411 HE21 ' HB2' ' B' ' 3' ' ' GLN . 0.0 OUTLIER -55.41 -34.34 64.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.511 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' MET . . . . . 0.4 ' HE3' ' HB3' ' A' ' 6' ' ' GLU . 45.8 ttm -63.26 -49.92 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.256 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 68.6 mt -68.46 -46.72 69.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.955 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.518 HD21 ' OE1' ' A' ' 39' ' ' GLN . 63.0 tp -56.85 -44.46 82.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.556 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -68.27 -39.58 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.615 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.49 79.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.15 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.9 -40.65 96.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.279 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -64.01 -44.22 93.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.793 0.33 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -64.05 -58.67 5.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.473 0.654 . . . . 0.0 110.776 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 21.2 tp -57.95 -36.97 73.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.43 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.922 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.548 0.213 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 82.5 p -173.49 132.76 0.47 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.839 0.352 . . . . 0.0 110.863 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -70.77 -133.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.004 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -58.39 141.6 50.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.179 0.514 . . . . 0.0 111.257 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 82.8 t -62.69 -42.27 95.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.494 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 47.3 mt-10 -56.4 -37.76 70.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.611 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.547 ' O ' HG12 ' A' ' 11' ' ' ILE . 22.1 t80 -60.01 -57.71 11.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.882 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.59 -33.27 75.53 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.645 0.735 . . . . 0.0 109.321 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 38.5 t-20 -54.45 -43.83 71.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.891 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.57 -41.5 65.66 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.242 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 7' ' ' PHE . 47.0 mm -51.75 -47.15 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.373 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -55.54 -36.61 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.183 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.571 ' O ' HG13 ' A' ' 17' ' ' ILE . 26.5 t80 -62.46 -54.27 42.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.191 0.519 . . . . 0.0 109.68 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' B' ' 9' ' ' ALA . 61.2 t -57.75 -40.12 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.542 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.64 -53.03 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.437 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.617 ' HA ' HG23 ' A' ' 19' ' ' THR . 61.3 tttp -58.14 -36.72 73.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.937 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 13' ' ' TYR . 89.1 mt -61.43 -38.47 80.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.987 0.422 . . . . 0.0 110.286 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 29.6 mtpp -64.55 -45.22 88.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.255 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.617 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.7 t -74.83 -28.66 60.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.909 -179.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.426 ' N ' HG21 ' A' ' 19' ' ' THR . 26.6 tpt180 -63.51 -56.47 15.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.974 0.416 . . . . 0.0 111.143 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.652 ' CD2' HG13 ' A' ' 27' ' ' ILE . 50.6 m-85 -97.11 48.21 1.05 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.3 mt -52.71 -40.46 63.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.692 0.282 . . . . 0.0 111.111 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -77.31 -27.32 52.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.189 0.519 . . . . 0.0 110.036 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 63.6 m170 -109.76 73.41 0.66 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.735 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -65.82 -32.71 45.62 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.311 2.007 . . . . 0.0 112.126 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -54.91 -32.09 60.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.512 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.652 HG13 ' CD2' ' A' ' 21' ' ' PHE . 2.4 mm -63.81 -48.53 85.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.958 0.409 . . . . 0.0 110.345 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.558 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.8 t80 -56.81 -48.98 76.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.532 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -56.95 -54.9 41.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.452 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.558 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.9 m -53.05 -46.43 68.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.934 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.543 ' HA ' HD13 ' A' ' 34' ' ' ILE . 43.7 t80 -52.63 -48.07 66.63 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.002 0.429 . . . . 0.0 110.699 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.647 HD23 ' HB3' ' B' ' 9' ' ' ALA . 48.9 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.284 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.534 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.0 mm-40 -61.68 -31.79 71.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.18 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 30' ' ' SER . 68.0 mt -62.23 -55.81 21.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.429 . . . . 0.0 109.898 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 38' ' ' TYR . 43.1 mt -60.58 -39.69 88.96 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.56 ' HA ' HD23 ' B' ' 6' ' ' LEU . 9.7 m-70 -58.07 -42.83 86.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.596 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.478 HG23 ' SD ' ' A' ' 53' ' ' MET . 89.4 m -59.65 -34.06 72.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.307 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 49.2 t80 -62.74 -62.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.208 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' HG2' ' A' ' 42' ' ' GLN . 16.8 mt-30 -60.26 -43.18 96.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.274 -179.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 59.7 mtpt -54.02 -41.23 67.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.692 0.282 . . . . 0.0 111.574 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -71.47 -49.74 38.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.532 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 2.8 pt20 -60.95 -39.9 91.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -178.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 97.3 mt -57.78 134.06 55.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.998 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 25.5 m170 76.8 48.67 0.06 Allowed 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.5 m -52.13 140.08 21.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.28 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 44' ' ' HIS . 34.5 mmtp -135.41 -54.59 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.32 -147.84 1.77 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.373 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.8 mtm105 -77.65 138.96 62.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.72 122.79 12.26 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.382 2.055 . . . . 0.0 111.789 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 63.89 122.29 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.04 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -177.89 -46.49 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.452 0.644 . . . . 0.0 111.079 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.75 -128.37 0.32 Allowed Glycine 0 C--N 1.311 -0.81 0 CA-C-N 114.757 -1.11 . . . . 0.0 113.064 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.478 ' SD ' HG23 ' A' ' 37' ' ' THR . 26.2 ttt -66.68 145.6 55.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.033 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.429 ' HG ' ' H ' ' A' ' 55' ' ' GLU . 20.6 t -159.02 -150.22 0.23 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.429 ' H ' ' HG ' ' A' ' 54' ' ' SER . 49.5 mm-40 -65.07 -32.23 73.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.898 0.38 . . . . 0.0 110.955 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -60.0 -50.11 75.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.793 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.486 ' O ' ' HB ' ' A' ' 60' ' ' THR . 29.9 tt0 -73.61 -47.31 41.21 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 97.5 t -53.38 -44.78 55.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.98 0.419 . . . . 0.0 110.294 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.608 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.5 t80 -61.34 -30.75 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.271 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.486 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 58.5 m -66.76 -62.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.399 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.505 ' HB2' HG22 ' A' ' 34' ' ' ILE . 8.8 mp0 -57.06 -41.46 78.77 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.65 -44.34 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.729 0.3 . . . . 0.0 110.428 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.713 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.29 -41.67 97.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 0.0 109.986 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -62.31 -41.96 98.97 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.844 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.509 HD21 HG21 ' A' ' 27' ' ' ILE . 4.7 mt -63.51 -64.05 1.01 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.412 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.483 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.3 m-30 -73.61 38.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.613 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.406 ' H ' ' C ' ' A' ' 65' ' ' LEU . 30.8 tpt180 -62.72 130.68 46.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.825 0.345 . . . . 0.0 110.201 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.07 -44.3 3.11 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.72 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.469 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.54 54.8 3.29 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.038 0.447 . . . . 0.0 110.309 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 70' ' ' GLU . 4.8 mm-40 -60.73 -3.76 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.493 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.1 -50.29 73.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.909 0.385 . . . . 0.0 110.587 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.446 HD13 ' HE1' ' A' ' 21' ' ' PHE . 85.9 mt -68.02 -36.1 79.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.21 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.713 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.37 -37.71 65.29 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.74 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.454 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 39.0 t -56.74 -42.28 79.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.877 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.47 -41.08 76.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.608 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.9 t80 -57.0 -43.25 81.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.81 -34.05 88.86 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.948 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 74' ' ' SER . 83.8 mt-30 -49.52 -49.95 43.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.707 0.289 . . . . 0.0 111.464 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -67.47 -41.29 84.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 110.555 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 76' ' ' PHE . 66.6 mt -61.49 142.39 94.07 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.3 82.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.815 2.344 . . . . 0.0 112.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.449 ' HG3' ' H ' ' A' ' 84' ' ' LYS . 5.5 tp10 -59.45 139.3 57.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.239 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.416 ' HB1' ' HD3' ' A' ' 84' ' ' LYS . . . -57.36 -38.43 74.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.942 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.551 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -163.82 130.04 3.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.51 179.782 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.603 ' HA ' HH11 ' A' ' 85' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.947 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 19.5 p30 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.824 0.345 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.44 HD13 HD22 ' A' ' 80' ' ' LEU . 40.1 mm -61.37 -36.46 73.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.148 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.92 -39.3 39.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.318 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 56.7 mtm -71.14 -42.62 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.059 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.43 ' HA ' HD11 ' B' ' 5' ' ' LEU . 22.6 tp -65.33 -53.11 48.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.403 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.56 HD23 ' HA ' ' A' ' 36' ' ' HIS . 34.7 tp -57.85 -39.3 77.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 109.911 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -66.02 -36.64 83.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.401 ' O ' ' HB3' ' B' ' 11' ' ' TYR . . . -57.44 -42.47 82.51 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.172 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.647 ' HB3' HD23 ' A' ' 32' ' ' LEU . . . -55.99 -45.85 78.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.995 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -59.46 -38.3 80.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.306 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.496 ' CD2' HD13 ' A' ' 11' ' ' ILE . 45.6 t80 -58.93 -54.99 40.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.306 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.86 -43.46 98.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.143 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' B' ' 9' ' ' ALA . 56.1 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.94 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.861 0.362 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.6 m -160.68 39.29 0.16 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -177.63 45.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.538 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -122.11 152.66 39.64 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.175 0.512 . . . . 0.0 111.323 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.554 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 96.0 t -61.35 -34.21 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.748 178.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.427 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 93.7 mt-10 -60.84 -36.93 80.37 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.424 ' O ' HG12 ' A' ' 11' ' ' ILE . 11.9 t80 -59.5 -58.31 9.16 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -65.39 -29.32 70.02 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.1 t-20 -58.06 -40.16 80.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.587 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.29 -46.12 57.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.676 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 7' ' ' PHE . 35.0 mm -51.93 -45.52 40.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.095 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.562 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 92.9 p -56.97 -38.7 73.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.164 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.619 ' HH ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 t80 -62.77 -54.8 33.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.961 0.41 . . . . 0.0 110.665 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.94 -39.85 68.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.99 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -58.44 -55.47 34.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.539 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.64 ' HA ' HG23 ' A' ' 19' ' ' THR . 27.2 mtpp -53.03 -37.67 61.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.2 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' HD1' ' A' ' 21' ' ' PHE . 80.0 mt -62.02 -40.23 86.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.139 0.495 . . . . 0.0 110.231 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.458 ' NZ ' ' HB3' ' B' ' 12' ' ' LEU . 41.3 ttmt -66.73 -54.0 27.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.902 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.64 HG23 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -62.91 -32.27 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.87 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.542 ' N ' HG21 ' A' ' 19' ' ' THR . 12.2 tpp85 -69.24 -49.15 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.072 0.463 . . . . 0.0 110.924 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.516 ' CE2' HG22 ' A' ' 27' ' ' ILE . 17.8 m-85 -92.64 40.86 1.06 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.816 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 19' ' ' THR . 38.3 mt -61.56 -35.87 79.01 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.04 -37.97 61.56 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.976 0.417 . . . . 0.0 110.482 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.502 ' HB2' ' CG1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -115.44 74.57 4.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.065 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.29 -29.78 80.42 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.575 2.183 . . . . 0.0 111.908 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -52.03 -30.98 27.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.813 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.55 HG21 HD21 ' A' ' 65' ' ' LEU . 1.6 mm -63.77 -39.55 85.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.301 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.58 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 68.2 t80 -56.44 -48.14 77.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.56 HH11 ' HA ' ' A' ' 29' ' ' ARG . 4.2 mmm180 -56.51 -57.41 12.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.799 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.656 ' HG ' HD12 ' A' ' 65' ' ' LEU . 32.5 p -48.82 -48.73 41.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.662 ' HA ' HD13 ' A' ' 34' ' ' ILE . 51.7 t80 -51.7 -47.41 63.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.071 0.462 . . . . 0.0 110.637 178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' B' ' 9' ' ' ALA . 49.2 mt -58.61 -40.95 84.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.139 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 57.6 mm-40 -63.24 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.051 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.775 HG23 HG21 ' A' ' 62' ' ' VAL . 53.1 mt -62.9 -56.85 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-O 120.96 0.41 . . . . 0.0 110.244 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.533 ' O ' ' HB3' ' A' ' 38' ' ' TYR . 72.1 mt -59.81 -37.3 78.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.551 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 5.3 m-70 -62.29 -41.62 98.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.573 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m -61.72 -38.54 88.27 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.194 0.521 . . . . 0.0 109.853 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.642 ' HB2' HG23 ' A' ' 58' ' ' VAL . 30.5 t80 -54.47 -56.55 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.774 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.456 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 4.2 mm100 -58.38 -42.97 88.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.126 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 28.8 mtpp -58.22 -54.91 41.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.93 -37.95 79.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.593 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.464 ' HG2' ' HG3' ' A' ' 49' ' ' PRO . 7.6 tt0 -54.68 -59.02 5.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.789 -179.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -68.03 152.1 46.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.039 0.447 . . . . 0.0 111.988 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.531 ' CD2' ' H ' ' A' ' 45' ' ' THR . 0.1 OUTLIER -168.52 -51.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.361 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.531 ' H ' ' CD2' ' A' ' 44' ' ' HIS . 39.5 p -156.86 -152.51 0.37 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.6 0.238 . . . . 0.0 110.516 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.443 ' HD2' ' N ' ' A' ' 46' ' ' LYS . 4.1 mptp? -73.74 175.14 7.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.755 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.21 137.83 0.13 Allowed Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.448 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.7 mtm105 -61.51 130.43 91.97 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.464 ' HG3' ' HG2' ' A' ' 42' ' ' GLN . 58.7 Cg_endo -71.13 143.58 44.66 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.071 2.514 . . . . 0.0 112.611 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -172.72 53.6 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.197 0.523 . . . . 0.0 110.538 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -154.31 -40.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.587 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.73 -133.18 0.52 Allowed Glycine 0 C--N 1.313 -0.741 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.985 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.437 ' SD ' ' HA ' ' A' ' 38' ' ' TYR . 26.1 ttt -70.91 150.85 45.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.608 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.3 p -156.99 -147.93 0.2 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.025 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.504 ' OE1' HD21 ' A' ' 80' ' ' LEU . 35.4 mm-40 -70.21 -28.4 65.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.522 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 22.6 pt-20 -55.22 -49.45 71.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.787 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 37.3 tp10 -74.92 -51.52 13.57 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.642 HG23 ' HB2' ' A' ' 38' ' ' TYR . 46.8 t -52.73 -44.12 46.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.165 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.572 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.2 t80 -62.41 -36.01 81.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -72.07 -50.97 23.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.937 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.616 ' HG3' HD12 ' A' ' 34' ' ' ILE . 4.6 tp10 -58.44 -45.79 87.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.01 -179.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.775 HG21 HG23 ' A' ' 34' ' ' ILE . 94.3 t -64.45 -43.03 96.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -60.45 -42.18 95.62 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.15 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -59.2 -39.73 83.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.321 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.656 HD12 ' HG ' ' A' ' 30' ' ' SER . 6.5 mt -68.49 -64.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.286 179.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.519 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 3.7 m-30 -74.18 41.65 0.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.65 -178.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -62.18 137.55 58.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.867 0.365 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.09 -45.01 3.25 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.323 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' A' ' 71' ' ' ASP . 17.7 mt-30 -88.02 52.88 2.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.064 0.459 . . . . 0.0 110.491 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.6 mt-10 -67.75 6.23 0.7 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.266 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 69' ' ' GLN . 55.0 m-20 -61.64 -48.98 78.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.174 0.511 . . . . 0.0 110.056 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.4 mt -72.32 -34.3 67.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.222 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -53.98 -38.16 64.73 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.993 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.511 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 41.7 t -55.11 -42.61 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.741 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.55 -45.84 78.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.592 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.619 ' HB2' ' HH ' ' A' ' 13' ' ' TYR . 22.7 t80 -57.54 -44.13 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.421 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.99 -41.9 98.44 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.709 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' ' 74' ' ' SER . 73.7 mt-30 -52.57 -44.92 66.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.817 0.309 . . . . 0.0 111.646 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -64.32 -40.42 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.011 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 76' ' ' PHE . 35.0 mt -65.39 130.08 94.58 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.223 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.466 ' HD2' ' HG3' ' A' ' 55' ' ' GLU . 47.9 Cg_endo -67.95 125.32 12.95 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.455 2.104 . . . . 0.0 112.116 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -92.26 44.23 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.816 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -173.73 133.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.389 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -74.91 -128.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.613 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.882 179.863 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.869 0.366 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 46.2 mm -67.64 -35.77 73.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.443 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -35.98 55.23 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 66.1 mtt -65.15 -47.33 77.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.528 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.473 HD23 ' HD2' ' A' ' 13' ' ' TYR . 80.2 mt -69.78 -45.7 67.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.959 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.456 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 56.0 tp -57.41 -44.35 84.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -72.53 -38.48 68.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.786 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.45 -41.77 77.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.209 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.581 ' HB3' HD23 ' A' ' 32' ' ' LEU . . . -55.05 -43.24 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.971 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.67 -38.04 89.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.428 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -57.13 -55.44 34.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.059 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.458 ' HB3' ' NZ ' ' A' ' 18' ' ' LYS . 95.9 mt -64.42 -49.29 72.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.526 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.196 179.683 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 2' ' ' SER . 35.9 tp10 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.425 ' N ' ' HG3' ' A' ' 1' ' ' GLU . 80.5 p -61.57 131.25 49.48 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.715 0.293 . . . . 0.0 110.979 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.6 t70 63.19 119.04 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.997 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -66.65 142.52 57.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.121 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.532 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 99.0 t -58.44 -41.73 82.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.222 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 50.5 mt-10 -58.57 -39.48 80.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.446 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.474 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.7 t80 -58.93 -57.37 13.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.933 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.25 -31.83 73.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.532 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.9 t-20 -55.16 -41.28 71.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.658 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.97 55.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.048 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 7' ' ' PHE . 32.6 mm -52.94 -45.3 51.45 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.081 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.319 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -57.44 -36.25 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.191 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.52 ' O ' HG13 ' A' ' 17' ' ' ILE . 10.1 t80 -65.97 -53.16 42.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.651 HG13 HD13 ' B' ' 12' ' ' LEU . 46.2 t -59.04 -44.24 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.499 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.78 -59.9 4.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.197 0.522 . . . . 0.0 111.198 -179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' HA ' HG23 ' A' ' 19' ' ' THR . 88.3 tttt -53.48 -38.63 63.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.711 -179.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.2 mt -62.37 -40.6 88.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.965 0.412 . . . . 0.0 110.214 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -63.91 -58.27 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.596 HG23 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -58.16 -31.45 67.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.475 -179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.533 ' N ' HG21 ' A' ' 19' ' ' THR . 33.7 tpt85 -64.74 -57.59 8.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.383 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.503 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.0 m-85 -92.98 40.66 1.06 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.392 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 19' ' ' THR . 62.9 mt -54.59 -34.77 62.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -75.26 -39.22 60.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -105.72 78.87 0.48 Allowed Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.401 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.428 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 21.4 Cg_endo -59.26 -35.3 97.48 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.726 2.284 . . . . 0.0 112.46 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -50.8 -31.42 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.422 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.4 mm -64.27 -46.77 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 0.0 110.646 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.544 ' CE2' HD13 ' A' ' 32' ' ' LEU . 51.4 t80 -56.76 -49.97 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.043 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.67 -53.39 58.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.719 -179.699 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.539 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.9 m -51.89 -51.7 55.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.451 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.482 ' CZ ' HD13 ' A' ' 35' ' ' LEU . 45.0 t80 -52.06 -49.0 64.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.053 0.454 . . . . 0.0 111.119 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.544 HD13 ' CE2' ' A' ' 28' ' ' TYR . 80.4 mt -61.8 -42.13 98.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.7 mm-40 -61.03 -34.3 74.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.358 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.735 HG22 ' HB2' ' A' ' 61' ' ' GLU . 86.4 mt -61.99 -60.64 2.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.175 0.512 . . . . 0.0 110.45 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.482 HD13 ' CZ ' ' A' ' 31' ' ' PHE . 89.8 mt -57.93 -37.97 75.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.635 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.536 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.47 -43.34 99.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.13 179.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.543 ' HA ' ' HZ3' ' A' ' 40' ' ' LYS . 89.2 m -56.91 -43.09 81.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.144 0.497 . . . . 0.0 110.406 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.487 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 42.9 t80 -65.84 -55.83 15.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.948 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.439 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 3.0 tp-100 -59.6 -48.87 79.99 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.322 -0.854 . . . . 0.0 113.056 -178.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HZ3' ' HA ' ' A' ' 37' ' ' THR . 10.4 mtmp? -52.38 -50.21 62.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.643 0.258 . . . . 0.0 111.346 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.414 ' OE1' ' HG2' ' A' ' 53' ' ' MET . 55.6 mt-10 -68.14 -36.82 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.9 0.381 . . . . 0.0 110.664 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.38 -39.91 84.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.913 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.5 mt -54.06 -39.87 66.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.421 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -167.51 137.56 2.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.9 p -77.18 56.58 1.31 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.785 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -126.86 120.83 30.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.0 110.883 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.78 -144.86 10.99 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.782 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 57.0 mtt85 -88.13 147.05 39.6 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.631 0.253 . . . . 0.0 111.112 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.21 144.72 46.83 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.77 2.313 . . . . 0.0 112.08 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 53' ' ' MET . 10.7 t80 -155.04 144.84 21.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.67 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.666 HH11 ' H ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -77.08 51.53 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.412 -179.217 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.06 151.75 2.91 Favored Glycine 0 C--N 1.322 -0.229 0 CA-C-N 115.694 -0.685 . . . . 0.0 113.392 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.566 ' SD ' ' HG2' ' A' ' 57' ' ' GLU . 16.9 tpt -153.68 135.56 14.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.539 -0.33 . . . . 0.0 110.616 -179.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.487 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 78.9 p -167.41 -149.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.148 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -68.77 -33.21 73.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.406 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.5 pt-20 -56.27 -46.04 79.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.43 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.566 ' HG2' ' SD ' ' A' ' 53' ' ' MET . 34.9 tp10 -68.42 -53.25 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.529 HG12 HG23 ' A' ' 34' ' ' ILE . 37.6 t -53.25 -44.37 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.159 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.489 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.1 t80 -59.96 -37.81 80.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.326 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.7 m -72.31 -51.1 22.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.721 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.735 ' HB2' HG22 ' A' ' 34' ' ' ILE . 56.6 mm-40 -58.28 -48.17 81.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.485 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.4 t -64.12 -42.12 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.887 0.375 . . . . 0.0 110.237 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.596 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.13 -40.1 92.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.019 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -58.79 -40.45 84.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.457 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.462 HD21 HG21 ' A' ' 27' ' ' ILE . 6.1 mt -68.29 -62.85 1.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.122 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.4 ' HZ ' HD12 ' A' ' 17' ' ' ILE . 5.1 m-30 -74.82 41.41 0.16 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.669 -179.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -64.02 133.47 53.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.718 0.294 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.34 -42.09 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.242 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -81.03 56.0 2.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.63 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 54.4 mt-10 -60.01 -4.57 0.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.073 -179.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.38 -53.82 51.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.939 0.4 . . . . 0.0 110.244 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.1 mt -71.56 -33.64 69.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.417 0.627 . . . . 0.0 109.509 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.63 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -53.85 -38.72 64.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.996 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -57.8 -42.23 83.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.929 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 59.8 mm-40 -62.71 -53.95 46.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.489 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.2 t80 -58.74 -38.97 79.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.2 0.524 . . . . 0.0 110.868 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.19 -49.46 72.06 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.396 -0.82 . . . . 0.0 114.111 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 21.4 pt20 -56.96 -37.01 70.98 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.267 0.533 . . . . 0.0 111.295 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.47 ' HD1' ' HG3' ' A' ' 78' ' ' GLN . 2.8 m-85 -58.17 -48.11 81.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.953 0.406 . . . . 0.0 110.445 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.7 mt -75.77 144.28 76.32 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.503 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.04 136.46 73.13 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.55 2.167 . . . . 0.0 112.178 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 64.44 118.87 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.932 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -179.58 134.75 0.12 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.07 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.637 ' HD2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -173.66 141.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.153 179.681 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.411 HH11 ' HG3' ' A' ' 85' ' ' ARG . 32.5 tpt85 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.932 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.474 ' O ' ' HB ' ' B' ' 2' ' ' ILE . 15.3 p-10 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.54 0.209 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.474 ' HB ' ' O ' ' B' ' 1' ' ' ASN . 32.1 mm 72.04 -37.67 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.833 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . 0.438 ' H ' ' C ' ' B' ' 1' ' ' ASN . 0.0 OUTLIER -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.089 0.471 . . . . 0.0 109.816 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 60.2 mtm -59.12 -41.88 89.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.523 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.446 HD11 HD12 ' A' ' 35' ' ' LEU . 54.9 mt -71.02 -46.27 62.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.464 ' HA ' HD11 ' B' ' 6' ' ' LEU . 3.3 mm? -57.5 -42.66 83.16 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.287 0.565 . . . . 0.0 109.77 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.34 -40.08 85.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.918 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.13 83.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.584 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.5 -43.47 79.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -39.3 93.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.72 -57.73 9.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.494 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.651 HD13 HG13 ' A' ' 14' ' ' VAL . 97.4 mt -60.77 -47.87 84.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.347 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.865 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.606 0.241 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.3 m 53.57 -149.01 0.43 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.185 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.32 -138.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.982 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.504 ' HG ' ' H ' ' A' ' 6' ' ' GLU . 6.7 t -64.55 153.08 40.23 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.578 0.704 . . . . 0.0 112.298 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.629 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 58.9 t -55.43 -36.42 41.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.942 178.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.504 ' H ' ' HG ' ' A' ' 4' ' ' SER . 44.0 mt-10 -58.7 -39.71 81.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.307 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.442 ' O ' HG12 ' A' ' 11' ' ' ILE . 12.9 t80 -60.8 -56.44 21.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.35 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.54 -34.6 78.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.629 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 5.6 t-20 -58.74 -37.0 75.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.578 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -41.99 65.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.734 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 7' ' ' PHE . 44.7 mm -53.75 -44.18 58.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.324 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.4 p -56.44 -36.21 68.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.01 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.581 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.1 t80 -66.9 -55.54 14.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.887 0.375 . . . . 0.0 110.841 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.481 HG11 ' HE1' ' A' ' 28' ' ' TYR . 34.0 t -60.0 -44.52 94.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.3 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -60.39 -53.88 52.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.957 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HA ' HG23 ' A' ' 19' ' ' THR . 87.7 tttt -53.72 -38.52 64.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.94 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 13' ' ' TYR . 90.0 mt -61.39 -36.59 74.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.807 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.626 ' HB2' ' HZ3' ' A' ' 18' ' ' LYS . 5.2 ttmp? -64.8 -51.87 59.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.83 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -67.43 -29.3 68.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.646 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.506 ' N ' HG21 ' A' ' 19' ' ' THR . 27.1 tpt180 -64.54 -62.05 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.567 ' CD2' HG13 ' A' ' 27' ' ' ILE . 49.1 m-85 -94.83 44.66 1.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.849 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -53.53 -35.99 61.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 111.063 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -75.19 -35.91 61.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.096 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -106.15 78.56 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.365 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.48 -34.52 98.13 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.82 2.347 . . . . 0.0 112.417 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -51.79 -32.46 31.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.581 HG21 HD23 ' A' ' 65' ' ' LEU . 10.4 mm -64.5 -48.96 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.481 ' HE1' HG11 ' A' ' 14' ' ' VAL . 61.6 t80 -58.44 -50.01 75.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.995 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -59.53 -56.65 19.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.343 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.615 ' O ' HG13 ' A' ' 34' ' ' ILE . 46.8 t -44.81 -51.91 9.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.528 -179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -50.36 -47.11 56.24 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.085 0.469 . . . . 0.0 110.779 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 52.0 mt -63.26 -38.9 92.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.07 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.2 tp10 -64.69 -30.26 71.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.833 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.798 HG23 HG21 ' A' ' 62' ' ' VAL . 56.3 mt -63.78 -58.21 8.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.072 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.44 -36.25 71.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 2.2 m-70 -62.01 -48.27 81.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.4 m -54.79 -43.79 73.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.47 ' HA ' ' SD ' ' A' ' 53' ' ' MET . 5.7 t80 -50.81 -40.76 56.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.472 ' HG3' HD23 ' B' ' 6' ' ' LEU . 3.6 mm100 -75.35 -38.67 59.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.282 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 47.6 mmtm -61.18 -56.39 21.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.68 50.79 1.38 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.647 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -145.3 -52.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 0.0 111.252 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.425 ' O ' ' HD2' ' A' ' 44' ' ' HIS . 95.8 mt -83.62 37.39 0.58 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.575 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 43' ' ' LEU . 60.2 m170 -135.86 126.59 27.3 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.3 p -138.0 133.4 33.59 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.699 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 46' ' ' LYS . 15.9 tptm -176.68 47.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.124 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.4 -145.09 5.88 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.274 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 75.0 mtt-85 -73.78 138.24 76.8 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.584 0.231 . . . . 0.0 110.766 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.18 129.56 33.59 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.575 2.184 . . . . 0.0 112.248 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -177.82 140.45 0.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.734 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -55.44 -37.88 68.27 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.408 0.623 . . . . 0.0 111.093 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.92 -46.55 2.4 Favored Glycine 0 C--N 1.315 -0.62 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.262 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.47 ' SD ' ' HA ' ' A' ' 38' ' ' TYR . 28.1 ttt -160.97 150.41 16.97 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.002 0.43 . . . . 0.0 111.438 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.405 ' HG ' ' HG2' ' A' ' 56' ' ' GLU . 80.7 p -164.91 -142.19 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.307 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -29.59 69.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.852 0.358 . . . . 0.0 110.733 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.405 ' HG2' ' HG ' ' A' ' 54' ' ' SER . 10.8 pt-20 -56.29 -49.37 74.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.12 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 41.4 tp10 -75.76 -49.49 18.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.5 t -52.78 -43.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.172 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.568 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 28.5 t80 -62.22 -36.14 81.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.601 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -72.84 -51.64 18.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.038 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.599 ' HB3' HG22 ' A' ' 34' ' ' ILE . 74.9 tt0 -57.8 -45.11 86.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.884 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.798 HG21 HG23 ' A' ' 34' ' ' ILE . 98.7 t -64.27 -42.74 96.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.76 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -59.83 -41.93 92.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.116 178.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -60.38 -39.94 89.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.232 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.581 HD23 HG21 ' A' ' 27' ' ' ILE . 1.2 mt -62.93 -64.99 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.909 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.463 ' HZ ' HD12 ' A' ' 17' ' ' ILE . 15.1 m-30 -74.76 42.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.812 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 -59.18 129.64 43.09 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.59 -42.5 2.94 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.901 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.6 OUTLIER -81.52 50.5 1.49 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.811 0.338 . . . . 0.0 110.527 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.506 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 51.2 mt-10 -61.6 -1.15 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 69' ' ' GLN . 1.5 m-20 -61.47 -47.79 84.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.109 0.48 . . . . 0.0 110.422 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.0 mt -71.98 -35.39 69.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.267 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.76 HD23 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.05 -39.85 66.6 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.157 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.415 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 39.7 t -54.59 -41.06 69.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.943 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -70.2 -45.35 66.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 21.3 t80 -57.14 -45.32 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.275 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -43.2 94.3 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.865 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 74' ' ' SER . 72.9 mt-30 -56.06 -43.82 78.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.78 0.324 . . . . 0.0 111.144 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.489 ' HD2' ' HE2' ' B' ' 4' ' ' MET . 1.9 m-85 -62.11 -41.75 98.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.065 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.0 mt -64.36 136.77 96.89 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.944 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.86 47.67 2.01 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.741 2.294 . . . . 0.0 112.639 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -61.33 -44.39 97.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.22 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 65.95 143.21 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.572 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -156.64 142.95 18.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.0 0.429 . . . . 0.0 111.162 -179.813 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.528 ' HD3' ' C ' ' A' ' 85' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.17 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.617 ' H1 ' HD21 ' B' ' 1' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.873 0.368 . . . . 0.0 111.635 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' B' ' 1' ' ' ASN . 24.7 mm 72.95 -39.08 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.527 0.078 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.975 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . 0.562 ' HG3' ' N ' ' B' ' 4' ' ' MET . 7.2 pt20 -56.77 -36.5 69.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.036 0.446 . . . . 0.0 110.233 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' MET . . . . . 0.562 ' N ' ' HG3' ' B' ' 3' ' ' GLN . 18.1 ptt? -62.82 -46.15 89.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.452 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.93 -43.76 74.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.16 0.505 . . . . 0.0 110.358 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.472 HD23 ' HG3' ' A' ' 39' ' ' GLN . 49.7 tp -60.99 -44.57 97.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.612 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -73.38 -35.17 65.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.644 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.11 -39.99 66.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.214 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.0 91.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.384 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.22 -50.67 72.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.946 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -59.24 -58.16 9.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.339 0.59 . . . . 0.0 111.163 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.559 HD22 ' NZ ' ' A' ' 18' ' ' LYS . 21.9 tp -55.65 -39.17 70.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.699 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.804 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' A' ' 1' ' ' GLU . 11.6 pm0 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.1 m -164.02 -43.49 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.712 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -78.76 48.62 0.83 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.315 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.87 143.98 24.21 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.46 0.648 . . . . 0.0 112.143 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.603 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 56.7 t -55.6 -40.3 58.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.381 178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.58 ' HB3' ' HE3' ' B' ' 4' ' ' MET . 52.3 mt-10 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.449 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.549 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.7 t80 -60.54 -54.71 42.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.727 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -32.59 74.31 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.49 0.662 . . . . 0.0 109.271 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 32.9 t-20 -54.46 -44.2 72.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.654 -1.157 . . . . 0.0 109.569 179.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.478 ' HB2' HD22 ' B' ' 5' ' ' LEU . . . -72.88 -43.72 62.19 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.066 179.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.941 HG22 HD13 ' B' ' 12' ' ' LEU . 50.2 mm -51.29 -48.23 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.444 -179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.1 p -55.33 -36.5 66.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.104 -179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.637 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -62.2 -49.32 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.034 0.445 . . . . 0.0 109.942 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.4 t -66.28 -37.69 80.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.87 -44.44 89.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.335 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' HA ' HG23 ' A' ' 19' ' ' THR . 53.9 tttp -66.99 -40.09 87.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.908 0.385 . . . . 0.0 110.701 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.1 mt -60.81 -43.06 94.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.458 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 39.1 ttpt -65.44 -54.62 25.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.88 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.6 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -60.0 -29.37 68.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.317 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.402 HH11 ' HG2' ' A' ' 20' ' ' ARG . 13.1 tpp85 -65.43 -56.99 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.171 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.577 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.5 m-85 -94.94 43.11 1.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.079 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 19' ' ' THR . 70.3 mt -55.4 -34.97 64.84 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.844 0.355 . . . . 0.0 110.921 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -74.66 -38.68 62.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.488 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -105.77 78.16 0.45 Allowed Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.22 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.91 -30.69 93.78 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.655 2.237 . . . . 0.0 112.266 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -52.58 -34.01 48.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.577 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.5 mm -64.76 -48.47 84.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.455 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.463 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 11.1 t80 -57.95 -57.24 13.66 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.063 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.722 ' HE ' ' HA ' ' A' ' 29' ' ' ARG . 2.0 mmp_? -50.12 -54.47 20.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.311 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 34' ' ' ILE . 69.4 m -53.57 -51.42 63.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.565 -179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.475 ' CE1' HG12 ' A' ' 62' ' ' VAL . 37.5 t80 -53.21 -51.01 63.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.965 0.412 . . . . 0.0 110.916 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 38.8 mt -59.81 -37.18 78.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.103 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 5.0 mm-40 -66.18 -31.27 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.805 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 30' ' ' SER . 82.8 mt -61.61 -56.73 15.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.459 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.25 -39.15 85.74 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 0.7 OUTLIER -61.14 -38.7 87.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.169 178.676 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.5 HG23 ' SD ' ' A' ' 53' ' ' MET . 76.1 m -62.68 -38.45 90.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.362 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.601 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 31.5 t80 -59.71 -64.09 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.408 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.515 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 3.2 mm100 -60.02 -43.17 95.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.095 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 36' ' ' HIS . 15.4 ttmm -58.05 -45.81 86.42 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.803 0.335 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -80.19 38.39 0.41 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -124.25 -33.2 3.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.763 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.2 mt -74.26 60.98 0.85 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.269 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -148.44 37.58 0.84 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.84 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.9 p 48.79 -139.63 0.75 Allowed 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.41 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -133.25 16.44 4.1 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.8 0.333 . . . . 0.0 110.575 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.73 -42.05 62.63 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.153 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.2 mtp-105 -57.89 140.97 81.25 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.641 0.258 . . . . 0.0 111.04 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -66.64 134.89 36.84 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.872 2.381 . . . . 0.0 112.698 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.414 ' C ' ' H ' ' A' ' 52' ' ' GLY . 15.6 t80 64.95 142.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.294 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.428 HH11 ' HG3' ' A' ' 51' ' ' ARG . 40.5 ttt85 -65.71 -2.06 3.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.189 0.519 . . . . 0.0 111.017 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . 56.17 -126.79 41.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.88 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.517 ' HE3' HG23 ' A' ' 58' ' ' VAL . 25.3 ttt -72.85 143.32 47.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.245 -0.477 . . . . 0.0 110.899 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.601 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 34.6 t -161.29 -64.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.0 0.428 . . . . 0.0 111.737 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.499 ' OE1' ' HD2' ' A' ' 81' ' ' PRO . 48.7 mt-10 -144.09 -38.96 0.29 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.241 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 10.5 pt-20 -59.97 -51.33 70.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.422 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 21.8 tt0 -72.69 -41.94 64.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.319 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.517 HG23 ' HE3' ' A' ' 53' ' ' MET . 46.7 t -55.46 -45.59 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.038 0.447 . . . . 0.0 110.357 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.583 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 29.0 t80 -65.75 -41.9 91.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.668 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.3 m -62.46 -48.5 79.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.936 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.688 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -59.03 -52.45 65.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.639 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.475 HG12 ' CE1' ' A' ' 31' ' ' PHE . 61.6 t -65.01 -45.33 94.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.394 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.734 ' HA ' HD22 ' A' ' 73' ' ' LEU . . . -61.4 -43.75 98.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.536 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.688 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 2.0 p30 -61.65 -38.68 88.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.84 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.8 mt -61.33 -63.27 1.34 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.631 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CZ ' HG22 ' A' ' 17' ' ' ILE . 7.5 m-30 -75.87 43.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.473 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.3 tpt180 -59.88 136.83 58.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.805 0.336 . . . . 0.0 110.662 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.73 -45.12 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.98 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -85.05 55.91 3.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.969 0.414 . . . . 0.0 110.407 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.13 -0.31 2.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.13 -43.73 98.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 110.733 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.31 -36.46 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.373 0.606 . . . . 0.0 110.353 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.734 HD22 ' HA ' ' A' ' 63' ' ' ALA . 0.4 OUTLIER -56.13 -36.83 68.68 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.268 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 40.3 t -53.12 -41.18 64.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.594 179.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -73.01 -39.82 65.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.835 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.637 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.2 t80 -57.18 -43.18 82.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.811 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.52 -36.27 92.95 Favored Glycine 0 N--CA 1.453 -0.231 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.923 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 74' ' ' SER . 25.4 mt-30 -52.08 -47.65 65.08 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.735 0.302 . . . . 0.0 111.192 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.36 -44.52 75.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.404 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 85.1 mt -62.94 125.5 86.81 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.841 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.499 ' HD2' ' OE1' ' A' ' 55' ' ' GLU . 11.7 Cg_exo -69.17 119.96 6.88 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.389 2.059 . . . . 0.0 112.001 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 179.34 -48.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.819 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 56.4 -143.65 0.7 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.995 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.626 ' HZ2' ' HB3' ' A' ' 84' ' ' LYS . 5.8 ttpm? 64.33 141.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.029 0.442 . . . . 0.0 111.255 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' A' ' 85' ' ' ARG . 11.7 tpt180 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.863 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.415 ' H1 ' ' HG3' ' B' ' 4' ' ' MET . 22.8 p30 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.125 0.012 . . . . 0.0 111.018 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 43.9 mm -53.33 -35.5 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.776 0.322 . . . . 0.0 110.736 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -54.97 -39.67 69.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' MET . . . . . 0.58 ' HE3' ' HB3' ' A' ' 6' ' ' GLU . 57.5 mtp -64.58 -48.37 75.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.483 -179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 10' ' ' ALA . 83.9 mt -65.89 -45.88 80.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.961 0.41 . . . . 0.0 110.671 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.515 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 57.1 tp -59.02 -48.29 82.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -64.1 -36.2 83.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.268 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' B' ' 11' ' ' TYR . . . -56.4 -50.63 71.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.478 ' O ' ' HG2' ' B' ' 13' ' ' GLU . . . -46.55 -44.9 18.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.214 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.14 -39.72 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.064 0.459 . . . . 0.0 110.479 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.455 ' HD2' HD11 ' B' ' 12' ' ' LEU . 74.2 t80 -60.29 -51.43 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.517 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.941 HD13 HG22 ' A' ' 11' ' ' ILE . 6.5 mp -63.13 -48.67 77.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.681 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 16.9 pt-20 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.918 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.504 0.193 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 8' ' ' ASN . 52.8 m -63.71 134.74 55.9 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.727 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.46 -66.68 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.22 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 140.65 53.23 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.097 0.475 . . . . 0.0 111.211 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 94.7 t -65.9 -43.63 92.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.289 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 52.1 mt-10 -58.47 -39.21 79.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.55 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.591 ' O ' HG12 ' A' ' 11' ' ' ILE . 19.0 t80 -59.76 -56.33 23.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.781 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 0.9 OUTLIER -65.06 -31.71 73.06 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.564 0.697 . . . . 0.0 109.23 178.563 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.8 t-20 -55.57 -43.42 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.554 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.02 65.76 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.715 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 7' ' ' PHE . 42.0 mm -52.75 -45.21 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.127 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.7 p -57.93 -35.28 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.7 t80 -62.86 -51.91 65.18 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.479 ' HB ' HD13 ' B' ' 12' ' ' LEU . 41.4 t -62.07 -42.03 93.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.416 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -60.41 -44.72 95.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.35 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.625 ' HA ' HG23 ' A' ' 19' ' ' THR . 62.3 tttp -67.79 -40.32 83.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.778 0.323 . . . . 0.0 110.607 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.4 mt -59.93 -40.96 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.306 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.24 -56.35 17.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.708 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.625 HG23 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.36 -29.5 70.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.85 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' N ' HG21 ' A' ' 19' ' ' THR . 35.1 tpt85 -65.91 -60.12 3.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.816 0.341 . . . . 0.0 111.309 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.531 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.8 m-85 -92.25 41.61 1.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.105 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.8 mt -53.49 -35.03 60.15 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.841 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -37.48 60.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.027 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.63 78.17 0.53 Allowed Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.271 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -58.95 -36.32 97.04 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.726 2.284 . . . . 0.0 112.528 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -50.5 -31.0 14.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.266 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.534 HG21 HD21 ' A' ' 65' ' ' LEU . 10.2 mm -64.33 -48.01 87.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.133 0.492 . . . . 0.0 110.471 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.494 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 57.6 t80 -62.64 -48.79 77.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.133 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -54.98 -54.81 38.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.561 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.657 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.5 t -54.06 -44.11 70.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.821 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.46 ' HA ' HD13 ' A' ' 34' ' ' ILE . 60.3 t80 -55.26 -46.4 76.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.909 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 69.6 mt -62.81 -47.25 84.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.898 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 30' ' ' SER . 24.6 pt-20 -62.69 -24.48 67.67 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.406 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.657 HG13 ' O ' ' A' ' 30' ' ' SER . 93.5 mt -66.94 -57.43 10.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.79 -40.05 82.89 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 121.525 0.679 . . . . 0.0 109.413 178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 3.8 m-70 -61.86 -49.13 77.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.23 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.641 HG23 ' SD ' ' A' ' 53' ' ' MET . 37.1 m -52.17 -42.03 63.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.796 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.753 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 47.9 t80 -54.07 -44.07 70.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.108 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.565 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 3.4 mm100 -73.04 -39.59 65.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.114 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 32.0 mmmt -56.47 -67.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 45' ' ' THR . 21.3 pt-20 -80.86 37.88 0.44 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 7.3 tt0 -95.43 -44.1 7.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.0 mt -52.34 -47.66 65.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.331 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.86 46.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.97 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.607 ' HA ' ' HB2' ' A' ' 41' ' ' GLU . 82.0 p 57.07 130.2 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.2 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HD2' ' O ' ' A' ' 45' ' ' THR . 32.0 mmmt -146.93 136.75 23.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.649 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.89 -104.28 1.37 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.67 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.9 mtt-85 -51.24 139.27 25.79 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 111.591 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.539 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 34.8 Cg_endo -63.37 -154.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.009 2.473 . . . . 0.0 112.555 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.539 ' HB3' ' O ' ' A' ' 49' ' ' PRO . 10.8 t80 84.01 141.72 0.06 Allowed 'General case' 0 C--O 1.232 0.179 0 O-C-N 123.692 0.62 . . . . 0.0 110.612 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -77.9 52.97 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.507 0.67 . . . . 0.0 111.799 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.98 123.59 1.96 Allowed Glycine 0 C--N 1.316 -0.546 0 CA-C-N 114.922 -1.035 . . . . 0.0 113.67 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.753 ' HE3' ' HB2' ' A' ' 38' ' ' TYR . 11.6 ttt -87.15 144.89 26.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.204 -0.498 . . . . 0.0 110.639 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.543 ' HG ' ' HG2' ' A' ' 56' ' ' GLU . 79.5 p -145.81 -154.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.025 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -58.53 -38.27 77.39 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.233 -179.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.543 ' HG2' ' HG ' ' A' ' 54' ' ' SER . 23.5 pt-20 -57.56 -46.01 84.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.541 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.733 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 10.9 tt0 -73.64 -44.17 57.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.764 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.448 HG21 ' CE ' ' A' ' 53' ' ' MET . 55.6 t -53.14 -47.54 55.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.766 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.56 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 30.6 t80 -63.81 -32.36 73.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.7 m -66.49 -58.3 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.942 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.545 ' HB2' HG22 ' A' ' 34' ' ' ILE . 56.0 mt-10 -57.1 -45.21 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.337 -179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.404 HG21 HG22 ' A' ' 34' ' ' ILE . 97.5 t -64.57 -42.78 96.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.628 0.251 . . . . 0.0 110.634 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.718 ' HA ' HD23 ' A' ' 73' ' ' LEU . . . -61.27 -40.86 95.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.911 0.386 . . . . 0.0 110.3 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -58.69 -39.62 81.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.131 179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.534 HD21 HG21 ' A' ' 27' ' ' ILE . 3.5 mt -67.45 -59.9 3.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.66 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -70.92 35.2 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.646 -1.161 . . . . 0.0 112.187 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 65' ' ' LEU . 38.5 ttm180 -63.1 119.86 10.34 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.08 -39.77 3.05 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.999 -179.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.427 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -83.94 53.05 2.45 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.958 0.408 . . . . 0.0 110.396 179.479 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -60.71 -7.11 2.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.019 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.648 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.7 p30 -64.08 -48.94 74.23 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.71 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.648 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 78.6 mt -72.3 -44.6 62.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.615 0.722 . . . . 0.0 109.46 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 63' ' ' ALA . 3.2 tp -52.45 -36.73 55.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.441 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 45.5 t -55.83 -44.3 77.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.582 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -66.57 -42.09 87.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.59 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.9 t80 -58.07 -44.95 87.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.68 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.42 -36.67 93.46 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.898 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 74' ' ' SER . 76.0 mt-30 -52.78 -47.64 67.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.624 0.249 . . . . 0.0 111.343 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.84 -45.01 83.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.833 0.349 . . . . 0.0 110.797 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.471 HD22 HD12 ' B' ' 2' ' ' ILE . 68.4 mt -66.26 133.3 94.53 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.79 123.93 10.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.248 1.965 . . . . 0.0 112.075 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -84.37 50.26 1.84 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.082 0.468 . . . . 0.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.32 -140.5 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.516 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.617 ' HZ2' ' HB3' ' A' ' 84' ' ' LYS . 6.2 ttpm? -61.1 143.72 54.91 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.138 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.907 -179.967 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ASN . . . . . 0.513 HD21 ' N ' ' B' ' 1' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.686 0.279 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ILE . . . . . 0.476 ' HB ' ' O ' ' B' ' 1' ' ' ASN . 43.3 mm 72.97 -36.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.226 -0.146 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.208 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' B' ' 1' ' ' ASN . 17.3 tp60 -64.45 -46.01 84.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.175 0.512 . . . . 0.0 109.824 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.9 mtm -72.41 -41.89 65.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.975 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.449 ' HA ' HD11 ' B' ' 5' ' ' LEU . 21.8 tp -64.23 -48.24 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.565 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 36.9 tp -59.96 -45.33 93.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.088 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -63.99 -33.28 75.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.306 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.18 -44.03 83.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.578 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -46.5 75.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.08 -35.95 76.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.375 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' TYR . . . . . 0.442 ' C ' ' H ' ' B' ' 13' ' ' GLU . 61.9 t80 -65.15 -47.54 76.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.136 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.479 HD13 ' HB ' ' A' ' 14' ' ' VAL . 93.3 mt -75.37 23.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.637 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.442 ' H ' ' C ' ' B' ' 11' ' ' TYR . 4.2 tm-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.547 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.59 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.796 0.332 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.527 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.2 mm -54.65 -43.31 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.3 m -58.45 -36.37 73.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.872 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.5 t80 -63.72 -53.73 46.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.935 0.398 . . . . 0.0 110.684 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.7 t -61.36 -42.49 93.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.351 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -58.46 -57.46 12.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.515 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -52.99 -40.03 63.5 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.504 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.9 mt -61.9 -40.96 89.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -65.23 -55.33 19.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.273 0.558 . . . . 0.0 110.689 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.549 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -60.41 -30.88 69.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.296 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -65.95 -56.38 11.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.205 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.515 ' CD2' HG13 ' A' ' 27' ' ' ILE . 54.2 m-85 -93.29 40.16 1.06 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.14 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 19' ' ' THR . 57.5 mt -55.35 -35.03 64.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.874 0.369 . . . . 0.0 110.63 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -75.43 -39.12 59.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.735 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.56 78.53 0.45 Allowed Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.244 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -60.25 -34.72 93.64 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.712 2.275 . . . . 0.0 112.388 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -51.01 -30.41 15.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.603 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.5 mm -63.94 -45.75 96.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.03 0.443 . . . . 0.0 110.817 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.513 ' CE2' HD11 ' A' ' 32' ' ' LEU . 43.5 t80 -54.91 -48.0 73.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.868 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.597 ' NH2' HD12 ' A' ' 32' ' ' LEU . 12.5 mmp_? -54.97 -51.86 64.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.47 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.3 t -54.53 -56.76 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.996 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.78 -50.72 32.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.043 0.449 . . . . 0.0 111.163 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.597 HD12 ' NH2' ' A' ' 29' ' ' ARG . 61.5 mt -60.99 -40.06 92.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.622 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.1 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.737 HG22 HG13 ' A' ' 58' ' ' VAL . 83.1 mt -63.87 -60.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.62 HD22 HG23 ' B' ' 2' ' ' ILE . 96.6 mt -55.89 -38.47 70.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.378 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -62.79 -46.62 87.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.869 179.136 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.7 m . . . . . 0 CA--C 1.52 -0.211 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.106 179.507 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 . . . . . 0 N--CA 1.46 0.069 0 CA-C-O 120.714 0.292 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.737 HG13 HG22 ' A' ' 34' ' ' ILE . 48.6 t -52.9 -42.3 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.721 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.2 t80 -60.05 -38.86 84.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.642 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -70.94 -50.61 32.71 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.638 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' HG23 ' A' ' 34' ' ' ILE . 92.5 mt-10 -57.3 -47.27 81.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.239 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.483 HG23 HG21 ' A' ' 34' ' ' ILE . 98.3 t -64.55 -41.38 92.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 1.005 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.77 -40.47 92.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.164 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -60.61 -40.72 92.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.468 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mt -63.94 -63.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.333 0.587 . . . . 0.0 110.769 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.496 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.3 m-30 -75.47 42.23 0.21 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.735 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 67' ' ' ARG . 12.0 tpt180 -59.13 130.97 49.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.648 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.22 -41.93 2.08 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.188 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -82.23 53.94 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.981 0.42 . . . . 0.0 110.535 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.706 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.4 mt-10 -63.46 1.7 0.51 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.179 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -61.47 -50.05 74.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.136 0.493 . . . . 0.0 109.874 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.28 -32.69 66.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.892 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 1.005 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.17 -38.94 68.97 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.259 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 t -56.86 -40.97 77.1 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.571 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -64.2 -50.26 68.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.463 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.606 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 14.7 t80 -58.08 -42.36 85.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.728 -179.945 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.62 HG23 HD22 ' A' ' 35' ' ' LEU . 46.9 mm . . . . . 0 N--CA 1.459 -0.017 0 CA-C-O 120.807 0.337 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -55.19 -40.91 71.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -66.22 -46.82 75.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.862 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.59 HD23 ' HB1' ' A' ' 10' ' ' ALA . 70.2 mt -67.41 -48.83 66.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.848 0.356 . . . . 0.0 111.181 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.7 tp -57.11 -45.03 83.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.591 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.74 -37.38 76.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.838 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.527 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -53.04 -41.78 65.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.557 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.58 -45.39 73.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.29 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -62.58 -39.41 93.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.722 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -57.53 -55.01 40.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.411 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.62 -45.27 91.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.92 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.263 0 CA-C-O 120.96 0.41 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.638 HD13 ' CB ' ' B' ' 8' ' ' ALA . 38.1 mm -50.58 -45.42 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.964 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.571 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 48.3 t -57.74 -38.9 76.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.597 -178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.693 ' HD2' HD11 ' B' ' 5' ' ' LEU . 29.9 t80 -61.96 -52.0 65.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' B' ' 8' ' ' ALA . 26.4 t -63.05 -36.08 74.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.599 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -66.32 -47.18 74.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.531 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 12' ' ' SER . 24.9 mtpp -61.54 -41.14 96.9 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 13' ' ' TYR . 96.7 mt -59.67 -37.53 71.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.841 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -67.27 -49.85 62.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.956 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.9 t -71.28 -28.16 63.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.91 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -65.33 -59.87 3.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.955 0.407 . . . . 0.0 111.253 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.558 ' CD2' HG13 ' A' ' 27' ' ' ILE . 66.9 m-85 -93.7 41.54 1.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.774 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 19' ' ' THR . 65.6 mt -54.16 -34.99 61.78 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.631 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -75.27 -37.75 60.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.428 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -106.71 78.56 0.57 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.25 -32.95 97.06 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.729 2.286 . . . . 0.0 112.327 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.24 -34.95 34.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.917 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.6 mm -64.58 -47.75 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.548 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 13.3 t80 -61.51 -59.32 5.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.602 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 22.4 mmt85 -49.79 -53.66 23.88 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.807 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.9 p -51.9 -51.54 56.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.075 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 34' ' ' ILE . 46.0 t80 -51.25 -50.06 59.95 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.076 0.465 . . . . 0.0 110.509 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 47.7 mt -57.36 -41.7 80.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.008 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 50.4 mt-10 -64.61 -30.21 71.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.531 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 30' ' ' SER . 66.6 mt -62.44 -54.55 32.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 120.968 0.413 . . . . 0.0 109.927 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' B' ' 6' ' ' LEU . 63.2 mt -61.7 -39.16 90.5 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -59.78 -42.61 93.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.938 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.6 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.214 179.479 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.462 0.126 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.502 ' O ' HG23 ' A' ' 62' ' ' VAL . 98.4 t -52.97 -43.37 47.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.037 0.446 . . . . 0.0 110.219 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.6 t80 -62.59 -35.17 78.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.502 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.8 m -67.16 -56.53 9.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.065 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -56.87 -44.49 82.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.417 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 58' ' ' VAL . 98.0 t -64.09 -41.71 93.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.201 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.953 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.57 -43.59 97.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.103 0.478 . . . . 0.0 110.271 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -61.45 -40.2 93.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.617 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 27' ' ' ILE . 2.8 mt -62.87 -63.83 1.1 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.45 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.521 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.1 m-30 -75.28 42.25 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.66 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -61.5 133.46 55.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 0.0 110.226 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.47 -45.58 3.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.776 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.7 OUTLIER -84.15 49.78 1.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.806 0.336 . . . . 0.0 110.318 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.647 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.7 mt-10 -65.19 6.32 0.28 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.652 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.9 p30 -66.88 -45.51 77.84 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.652 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 60.3 mt -72.72 -34.98 67.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.747 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.953 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -51.45 -43.88 62.21 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.223 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -55.88 -41.04 73.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.931 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -64.35 -45.51 87.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.698 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.624 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.0 t80 -57.96 -43.8 86.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.885 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.556 -179.596 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 35' ' ' LEU . 48.5 mm . . . . . 0 CA--C 1.526 0.032 0 CA-C-O 120.772 0.32 . . . . 0.0 111.361 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -61.02 -48.64 80.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.876 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 23.6 ptp -73.12 -40.82 64.61 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.148 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.693 HD11 ' HD2' ' A' ' 13' ' ' TYR . 26.7 tp -60.87 -50.73 72.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.032 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.5 tp -63.18 -40.81 98.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.149 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -60.6 -34.36 74.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.991 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.638 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.53 -42.29 78.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.141 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.537 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -58.11 -43.72 87.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.05 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -61.01 -42.81 99.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.499 ' HD2' HD12 ' A' ' 11' ' ' ILE . 39.8 t80 -61.28 -55.38 32.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.176 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.6 mt -60.81 -35.21 75.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.015 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.977 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.601 ' HB1' ' HA ' ' B' ' 5' ' ' LEU . . . . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.616 HD13 ' CB ' ' B' ' 8' ' ' ALA . 39.1 mm -60.77 -44.7 97.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.501 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 t -59.43 -42.29 91.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.64 ' HD2' HD11 ' B' ' 5' ' ' LEU . 12.6 t80 -59.37 -51.78 68.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.911 0.386 . . . . 0.0 110.501 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 ' HA ' ' B' ' 9' ' ' ALA . 47.7 t -57.33 -44.12 83.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -59.2 -58.27 9.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.173 0.511 . . . . 0.0 110.882 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.563 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.7 ttmt -53.45 -38.95 64.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.715 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.556 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 71.0 mt -61.77 -40.84 88.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.068 0.461 . . . . 0.0 110.149 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HZ3' HD13 ' B' ' 12' ' ' LEU . 3.4 ttmp? -65.17 -55.41 18.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.602 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.4 t -61.22 -30.29 70.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.79 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -63.75 -57.61 9.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.236 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD2' HG13 ' A' ' 27' ' ' ILE . 53.7 m-85 -95.52 43.44 1.09 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.047 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 19' ' ' THR . 66.6 mt -55.58 -35.5 65.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 110.751 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -74.77 -37.2 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.727 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -107.17 77.51 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.517 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.072 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -59.35 -33.72 97.66 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.591 2.194 . . . . 0.0 112.329 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -50.76 -32.28 19.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.044 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.524 HG13 ' CD2' ' A' ' 21' ' ' PHE . 7.8 mm -64.39 -47.8 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.706 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.564 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.2 t80 -59.8 -49.68 76.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.119 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -55.87 -53.2 59.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -52.88 -47.41 67.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.842 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HA ' HD12 ' A' ' 34' ' ' ILE . 41.9 t80 -53.7 -48.57 69.41 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.169 0.509 . . . . 0.0 110.88 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 51.9 mt -59.71 -46.76 88.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.438 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 44.2 tt0 -58.81 -30.59 67.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 30' ' ' SER . 97.2 mt -62.24 -60.45 2.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.737 ' HB2' HD13 ' B' ' 6' ' ' LEU . 58.6 mt -59.95 -35.84 75.8 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 15.3 m-70 -61.63 -42.98 99.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.943 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.1 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.167 0.508 . . . . 0.0 110.319 179.558 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 . . . . . 0 CA--C 1.527 0.075 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.516 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 65.7 t -52.83 -41.14 38.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.724 0.297 . . . . 0.0 110.848 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.47 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 21.0 t80 -61.71 -39.13 90.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.401 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 16.4 m -67.59 -50.83 56.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.882 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 57.8 mm-40 -56.88 -48.68 77.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.484 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.48 -44.99 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.81 0.338 . . . . 0.0 111.586 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.985 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.1 -44.2 97.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.506 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 1.1 p30 -62.42 -38.96 91.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.109 0.481 . . . . 0.0 110.247 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.476 HD12 HD11 ' A' ' 34' ' ' ILE . 3.0 mt -60.05 -63.1 1.42 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.191 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.5 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 9.8 m-30 -74.2 41.19 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.597 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -61.06 131.86 51.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.361 . . . . 0.0 110.531 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -45.35 3.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.562 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -86.61 53.88 2.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.035 0.445 . . . . 0.0 110.341 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 95.5 mt-10 -59.97 -5.54 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.023 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -60.85 -45.23 95.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 0.0 110.018 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 17' ' ' ILE . 91.4 mt -71.98 -36.11 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.985 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.985 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -53.41 -44.25 68.59 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.73 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.3 m -53.47 -41.33 66.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.815 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.93 -46.91 70.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.08 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.566 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.9 t80 -57.7 -41.76 82.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.161 0.505 . . . . 0.0 110.021 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.76 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.706 HG23 HD22 ' A' ' 35' ' ' LEU . 44.7 mm . . . . . 0 C--O 1.228 -0.074 0 CA-C-O 120.59 0.233 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 tm0? -54.22 -41.34 68.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.498 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 64.4 mtt -70.31 -42.54 71.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.212 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.64 HD11 ' HD2' ' A' ' 13' ' ' TYR . 19.6 tp -64.42 -49.08 72.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.824 0.345 . . . . 0.0 110.968 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.737 HD13 ' HB2' ' A' ' 35' ' ' LEU . 30.8 tp -63.45 -43.25 97.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.15 -34.45 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.158 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.616 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.15 -38.97 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.502 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.94 -45.22 74.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.002 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -63.72 -39.15 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.59 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -55.83 -54.21 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.506 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.578 HD13 ' HZ3' ' A' ' 18' ' ' LYS . 95.8 mt -63.69 -45.86 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.266 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.861 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.281 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HB1' ' B' ' 8' ' ' ALA . 41.8 mm -54.02 -42.99 57.07 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.817 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 m -54.53 -38.53 66.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.132 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 39.4 t80 -66.86 -57.46 6.96 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.931 0.396 . . . . 0.0 111.019 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' B' ' 9' ' ' ALA . 39.5 t -57.19 -43.89 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.269 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.54 -52.39 63.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.993 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -53.36 -40.08 64.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.0 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.708 HG12 HD13 ' A' ' 72' ' ' LEU . 91.9 mt -62.31 -38.19 80.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.19 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -68.97 -49.23 59.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.075 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.6 t -69.82 -27.97 65.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.654 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.431 ' HG2' HH11 ' A' ' 20' ' ' ARG . 10.5 tpt180 -67.73 -58.45 4.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.571 ' HZ ' ' HG3' ' A' ' 69' ' ' GLN . 53.1 m-85 -90.94 38.89 0.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 72.7 mt -54.24 -34.87 61.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.044 0.449 . . . . 0.0 110.342 179.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.23 -37.22 61.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.42 78.69 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.121 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -59.04 -35.15 98.89 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.84 2.36 . . . . 0.0 112.809 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -50.84 -33.09 22.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.378 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.4 mm -64.54 -48.35 85.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.117 0.484 . . . . 0.0 111.036 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.543 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.0 t80 -59.27 -49.89 76.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.409 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -58.3 -56.17 25.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.041 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.638 ' HB2' HD11 ' A' ' 65' ' ' LEU . 60.7 m -53.44 -49.76 66.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.528 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.5 t80 -52.03 -49.68 62.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.986 0.422 . . . . 0.0 111.068 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 86.6 mt -58.66 -41.73 86.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.475 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.61 -30.25 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.121 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 30' ' ' SER . 78.1 mt -62.41 -55.1 26.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.832 HD22 HG23 ' B' ' 2' ' ' ILE . 54.2 mt -62.83 -38.62 91.51 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.449 0.643 . . . . 0.0 109.534 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -60.82 -47.23 87.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.221 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.4 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 179.374 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 . . . . . 0 C--O 1.231 0.1 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.545 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 59.6 t -53.55 -45.79 59.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.822 0.344 . . . . 0.0 110.832 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.581 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.4 t80 -60.23 -34.74 74.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.278 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.4 m -66.93 -58.81 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.048 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -56.72 -44.32 81.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.396 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.505 HG23 HG21 ' A' ' 34' ' ' ILE . 90.1 t -64.05 -42.17 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.474 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.37 -40.54 94.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.087 0.47 . . . . 0.0 110.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -61.29 -42.66 99.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.698 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.5 mt -67.13 -62.7 1.3 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.316 0.579 . . . . 0.0 110.952 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 3.3 m-30 -73.11 37.47 0.08 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.634 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' A' ' 69' ' ' GLN . 41.8 ttm180 -58.48 130.84 48.68 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.36 -31.83 2.1 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.764 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.571 ' HG3' ' HZ ' ' A' ' 21' ' ' PHE . 6.4 mm-40 -78.04 48.76 0.75 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.911 0.386 . . . . 0.0 110.492 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 4.9 mm-40 -56.08 -14.49 2.67 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.27 -49.83 75.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.639 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.708 HD13 HG12 ' A' ' 17' ' ' ILE . 88.0 mt -70.0 -34.04 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.234 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 1.3 mm? -58.51 -37.38 75.48 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.8 m -54.71 -39.26 68.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.322 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.51 -45.27 22.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.292 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.8 t80 -57.23 -43.78 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.134 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.989 -179.424 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.832 HG23 HD22 ' A' ' 35' ' ' LEU . 45.9 mm . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.703 0.287 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.75 -40.97 69.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.753 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 50.8 ttm -65.4 -45.38 84.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.498 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HB1' ' A' ' 10' ' ' ALA . 61.5 mt -65.66 -50.22 65.76 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.643 HD13 ' HB2' ' A' ' 35' ' ' LEU . 38.8 tp -58.02 -41.02 82.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.084 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -66.27 -37.54 85.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.287 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.747 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -59.16 -42.71 91.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.266 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.476 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.83 -46.84 81.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.119 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' B' ' 13' ' ' GLU . 8.2 t70 -57.47 -38.58 74.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.268 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' B' ' 8' ' ' ALA . 57.1 t80 -60.47 -50.66 72.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.436 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.437 HD21 ' CG2' ' A' ' 11' ' ' ILE . 86.2 mt -63.09 -49.81 73.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.804 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' B' ' 10' ' ' ASP . 16.4 pt-20 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.867 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.577 HD13 ' CB ' ' B' ' 8' ' ' ALA . 48.8 mm -51.63 -54.26 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.112 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.6 p -51.03 -33.62 26.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.781 ' HD2' HD11 ' B' ' 5' ' ' LEU . 30.9 t80 -63.2 -48.72 77.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.502 HG21 ' HB3' ' B' ' 8' ' ' ALA . 32.3 t -68.3 -40.24 82.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.742 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -62.24 -42.72 99.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.908 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.2 ttmt -66.24 -39.34 89.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.36 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 13' ' ' TYR . 85.7 mt -60.02 -40.82 84.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.175 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -64.47 -56.77 11.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.6 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.69 -29.67 70.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.008 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -68.09 -59.6 3.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.929 0.395 . . . . 0.0 111.283 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.549 ' CD2' HG13 ' A' ' 27' ' ' ILE . 60.3 m-85 -91.75 39.17 1.0 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.09 -37.24 53.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.964 0.411 . . . . 0.0 110.577 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.92 -37.46 58.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -104.16 78.61 0.34 Allowed Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.269 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -59.35 -35.42 96.69 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.87 2.38 . . . . 0.0 112.602 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -51.07 -33.12 24.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.048 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -64.44 -51.28 70.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.804 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 49.0 t80 -58.03 -47.73 82.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.629 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG2' HH11 ' A' ' 29' ' ' ARG . 49.7 mmt-85 -55.97 -52.22 64.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.319 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.629 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.0 m -53.69 -52.82 58.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.522 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -50.16 -51.67 41.66 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.088 0.47 . . . . 0.0 110.97 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 74.4 mt -58.17 -44.55 88.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.41 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 17.6 tp10 -62.13 -29.18 70.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.691 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.643 HG22 HG13 ' A' ' 58' ' ' VAL . 72.2 mt -64.33 -56.75 14.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.021 0.438 . . . . 0.0 109.935 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.79 HD22 HG23 ' B' ' 2' ' ' ILE . 56.9 mt -62.71 -40.08 96.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.458 0.647 . . . . 0.0 109.322 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 12.1 m-70 -59.14 -47.5 85.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 76.5 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.738 179.777 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 60' ' ' THR . 24.0 tt0 . . . . . 0 C--O 1.231 0.125 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.643 HG13 HG22 ' A' ' 34' ' ' ILE . 61.0 t -53.66 -43.46 54.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.872 0.368 . . . . 0.0 110.358 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 31.3 t80 -61.74 -33.61 74.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.197 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 45.3 m -68.0 -57.2 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.138 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.32 -43.06 83.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.513 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 58' ' ' VAL . 89.4 t -64.16 -41.35 92.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 110.119 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.784 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.63 -40.92 93.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.28 -37.55 87.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.936 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.546 HD22 HG23 ' A' ' 27' ' ' ILE . 5.6 mt -65.63 -65.45 0.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.494 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.708 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.3 m-30 -76.03 44.9 0.33 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.562 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -62.69 137.23 58.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.66 -43.98 2.87 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.295 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 71' ' ' ASP . 16.9 pt20 -96.16 56.45 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.757 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 57.8 mp0 -65.81 8.36 0.19 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.153 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.3 t70 -61.49 -44.64 96.72 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.25 -38.59 75.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.596 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.784 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -55.19 -39.77 69.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.946 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.7 t -56.13 -40.24 73.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.525 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -68.39 -44.45 75.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.793 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.605 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.0 t80 -56.97 -42.0 79.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.803 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.763 -179.947 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.79 HG23 HD22 ' A' ' 35' ' ' LEU . 47.4 mm . . . . . 0 CA--C 1.524 -0.042 0 CA-C-O 120.836 0.35 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -57.51 -45.37 85.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.571 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 77.4 mtp -71.89 -43.61 65.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.722 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.781 HD11 ' HD2' ' A' ' 13' ' ' TYR . 18.9 tp -61.05 -51.33 69.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.825 0.345 . . . . 0.0 110.795 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.709 HD13 ' HB2' ' A' ' 35' ' ' LEU . 29.8 tp -60.76 -38.42 85.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.098 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.85 -35.62 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.577 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.25 -39.61 66.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.317 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.66 -44.48 73.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -63.6 -39.29 94.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.928 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.429 ' HD2' HD12 ' A' ' 11' ' ' ILE . 43.1 t80 -57.85 -54.5 46.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.52 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -63.05 -47.38 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.114 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.871 179.96 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.706 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.235 0.331 0 CA-C-O 120.826 0.346 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.602 HD13 ' HB1' ' B' ' 8' ' ' ALA . 37.7 mm -52.61 -42.59 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.271 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.1 t -54.96 -38.03 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.107 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.608 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.6 t80 -67.48 -56.91 7.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.444 HG21 ' HB3' ' B' ' 8' ' ' ALA . 44.6 t -57.33 -40.43 74.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.217 0.532 . . . . 0.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.02 -54.97 21.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.053 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HA ' HG22 ' A' ' 19' ' ' THR . 63.4 tttm -53.71 -39.72 65.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.06 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.595 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 87.2 mt -62.73 -37.57 79.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.822 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -66.12 -47.93 72.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.916 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -70.74 -28.86 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.176 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.563 ' HG2' HD11 ' A' ' 72' ' ' LEU . 26.4 tpt180 -65.22 -56.7 11.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.49 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.3 m-85 -91.89 40.35 1.04 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.604 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 19' ' ' THR . 35.7 mt -56.61 -31.88 64.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.934 0.397 . . . . 0.0 110.649 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -74.71 -38.05 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.315 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.43 ' HB3' HG12 ' A' ' 27' ' ' ILE . 90.9 m-70 -106.66 78.92 0.59 Allowed Pre-proline 0 N--CA 1.447 -0.581 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.43 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 20.8 Cg_endo -58.98 -35.02 99.34 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.765 2.31 . . . . 0.0 112.604 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -53.01 -29.66 30.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.186 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.689 HG23 HD22 ' A' ' 65' ' ' LEU . 15.5 mm -64.25 -49.31 81.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.37 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.62 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.4 t80 -55.59 -50.83 69.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.847 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.43 -51.03 71.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.477 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.566 ' O ' HG13 ' A' ' 34' ' ' ILE . 48.3 t -52.31 -53.65 41.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.352 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -50.47 -50.36 52.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.254 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 29.4 mt -59.92 -40.55 89.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.4 mm-40 -64.73 -32.7 74.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.193 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 30' ' ' SER . 75.9 mt -61.47 -54.17 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 120.867 0.365 . . . . 0.0 110.367 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.673 HD22 HG23 ' B' ' 2' ' ' ILE . 77.5 mt -61.92 -42.3 98.93 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.56 -46.16 80.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.918 179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 95.8 m . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.971 179.847 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 . . . . . 0 N--CA 1.462 0.146 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.531 HG11 HD12 ' B' ' 2' ' ' ILE . 88.2 t -53.04 -44.9 52.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.171 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 18.0 t80 -61.92 -34.21 75.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.907 0.384 . . . . 0.0 110.688 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.9 m -66.06 -56.68 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.14 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HB2' HG23 ' A' ' 34' ' ' ILE . 58.7 mm-40 -58.6 -44.93 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.629 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.531 HG23 HG21 ' A' ' 34' ' ' ILE . 99.6 t -64.05 -42.47 95.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.736 0.303 . . . . 0.0 110.406 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.55 97.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.226 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -58.63 -41.72 86.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.039 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.689 HD22 HG23 ' A' ' 27' ' ' ILE . 4.8 mt -63.37 -60.18 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.555 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.567 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 5.3 m-30 -73.52 39.17 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.957 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.411 ' HG2' HH11 ' A' ' 67' ' ' ARG . 52.2 ttp85 -61.63 128.92 38.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.789 0.328 . . . . 0.0 110.42 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.19 -41.78 2.67 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.283 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -83.96 57.87 4.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.93 0.395 . . . . 0.0 110.998 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -63.65 -3.3 2.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.51 -54.98 36.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.925 0.393 . . . . 0.0 110.686 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' HG2' ' A' ' 20' ' ' ARG . 49.9 mt -68.62 -42.78 77.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.509 0.671 . . . . 0.0 109.933 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 tp -51.97 -38.14 55.57 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.206 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.3 t -55.73 -42.83 75.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.185 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 46.4 mt-10 -63.98 -45.29 89.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.292 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.608 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 16.3 t80 -57.54 -44.37 85.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.524 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.785 -179.957 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.673 HG23 HD22 ' A' ' 35' ' ' LEU . 45.5 mm . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -65.58 -33.91 77.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.073 0.464 . . . . 0.0 109.779 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.3 ttm -62.62 -49.01 76.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.634 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.706 HD23 ' HB1' ' A' ' 10' ' ' ALA . 79.3 mt -68.9 -46.05 69.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.48 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 35' ' ' LEU . 45.5 tp -56.22 -39.88 73.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.07 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.62 -39.73 77.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.237 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.602 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -55.71 -39.47 71.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.112 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.62 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.24 -46.49 79.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.369 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -60.48 -39.2 86.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.669 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.83 -54.82 42.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.422 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.99 -47.08 78.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.116 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.971 -179.77 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.599 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.658 0.266 . . . . 0.0 110.438 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.76 HD13 ' HB1' ' B' ' 8' ' ' ALA . 43.5 mm -54.27 -42.04 55.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 CA-C-O 120.964 0.411 . . . . 0.0 110.299 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.1 m -56.75 -38.17 72.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.594 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 15.5 t80 -68.43 -55.31 12.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.948 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.9 -44.24 90.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.126 0.489 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -60.18 -55.39 34.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.813 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.534 ' HA ' HG22 ' A' ' 19' ' ' THR . 65.6 tttm -56.42 -40.94 75.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.883 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.3 mt -60.49 -47.77 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.904 0.383 . . . . 0.0 110.64 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 38.7 ttpt -62.85 -56.68 15.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.751 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.0 t -57.29 -29.64 64.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.179 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -70.01 -55.65 9.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.768 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.489 ' CD2' HG13 ' A' ' 27' ' ' ILE . 57.2 m-85 -91.19 38.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.904 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 67.5 mt -52.8 -34.47 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.913 0.387 . . . . 0.0 110.675 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.31 -38.99 60.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -106.27 78.25 0.5 Allowed Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.234 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.98 -34.81 94.8 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.671 2.247 . . . . 0.0 112.458 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.0 -31.26 17.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.022 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.8 mm -64.33 -47.57 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 18' ' ' LYS . 62.0 t80 -58.51 -45.77 88.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.2 mmt-85 -60.01 -56.51 20.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.611 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.579 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -51.08 -49.14 61.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.988 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.8 t80 -51.23 -50.37 59.27 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.703 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.1 mt -60.22 -39.75 87.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.681 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.51 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.227 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.744 HG22 HG13 ' A' ' 58' ' ' VAL . 85.3 mt -61.47 -56.85 15.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.119 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.773 HD22 HG23 ' B' ' 2' ' ' ILE . 65.1 mt -60.7 -38.08 83.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.233 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -62.26 -38.39 89.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.225 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 93.3 m . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.079 0.466 . . . . 0.0 110.648 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 . . . . . 0 N--CA 1.461 0.087 0 CA-C-O 120.685 0.279 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.744 HG13 HG22 ' A' ' 34' ' ' ILE . 43.2 t -53.14 -44.05 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.216 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.588 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 35.3 t80 -60.15 -37.09 79.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.1 m -73.29 -48.06 37.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.82 -46.6 81.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.705 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 58' ' ' VAL . 74.4 t -64.69 -42.35 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.024 179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.29 -41.05 88.05 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 109.959 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -61.36 -40.09 93.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.532 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 6.3 mt -67.27 -63.94 0.96 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.789 ' HB2' HD23 ' A' ' 73' ' ' LEU . 4.5 m-30 -74.85 42.76 0.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.793 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -62.16 137.92 58.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.01 -45.01 2.69 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.016 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.43 ' H ' ' HG2' ' A' ' 69' ' ' GLN . 4.8 pt20 -95.56 51.83 1.32 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.143 0.496 . . . . 0.0 110.277 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -66.96 7.32 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.97 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.42 -45.09 95.78 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.401 HD21 ' NZ ' ' A' ' 16' ' ' LYS . 41.9 mt -69.12 -36.15 77.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.077 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 66' ' ' PHE . 0.1 OUTLIER -54.91 -40.27 69.67 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.705 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.8 t -56.04 -40.66 73.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.474 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -66.96 -38.47 86.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.064 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.4 t80 -57.5 -45.55 84.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.779 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.276 179.783 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.773 HG23 HD22 ' A' ' 35' ' ' LEU . 46.5 mm . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.796 0.332 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -55.82 -32.06 63.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.363 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.24 -45.75 91.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.086 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.599 HD23 ' HB1' ' A' ' 10' ' ' ALA . 66.1 mt -68.64 -46.21 69.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.058 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.72 -46.27 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -68.08 -37.26 81.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.552 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.76 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -58.52 -44.14 89.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.607 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.32 -43.16 96.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.395 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.14 -48.34 82.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 110.742 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -61.57 -56.58 18.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.387 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.479 HD13 ' CG2' ' A' ' 11' ' ' ILE . 22.5 tp -56.01 -48.59 75.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.752 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.928 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.584 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.912 0.387 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.495 HD13 ' CB ' ' B' ' 8' ' ' ALA . 46.7 mm -54.42 -44.93 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.096 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.9 p -58.5 -33.51 69.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.835 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.584 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 34.1 t80 -63.0 -53.26 56.8 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.455 HG11 ' HA ' ' B' ' 9' ' ' ALA . 45.3 t -63.77 -40.06 87.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.929 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.14 -45.5 93.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.136 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.2 tttt -65.57 -39.35 91.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.541 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.0 mt -60.93 -41.17 87.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.511 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -65.5 -56.18 13.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.602 179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -60.08 -29.13 68.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.472 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -66.55 -55.37 15.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.918 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.701 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 51.1 m-85 -97.2 45.73 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.022 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.27 -43.31 64.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.87 0.367 . . . . 0.0 110.933 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.08 -22.03 45.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.624 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.701 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.9 m170 -109.69 72.19 0.58 Allowed Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.482 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -66.05 -34.85 36.3 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.495 2.13 . . . . 0.0 112.379 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -52.28 -34.49 46.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.412 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.29 -45.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.127 0.489 . . . . 0.0 110.423 -179.875 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.401 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.1 t80 -53.44 -49.45 67.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.327 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -60.09 -54.61 43.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.759 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.588 ' OG ' HD11 ' A' ' 65' ' ' LEU . 36.1 t -51.56 -49.94 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.232 -179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.471 ' CZ ' HD11 ' A' ' 35' ' ' LEU . 36.2 t80 -53.52 -50.18 65.98 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.907 0.384 . . . . 0.0 110.94 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 96.0 mt -59.18 -37.3 77.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -62.41 -35.97 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.942 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.582 HD11 HD12 ' A' ' 65' ' ' LEU . 56.8 mt -61.69 -56.91 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.142 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.573 HD22 HG23 ' B' ' 2' ' ' ILE . 89.0 mt -57.86 -39.13 77.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.345 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.471 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -62.2 -40.05 94.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.872 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.8 m . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 121.228 0.537 . . . . 0.0 110.155 179.35 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.581 HG13 HG22 ' A' ' 34' ' ' ILE . 39.2 t -52.3 -47.38 45.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.689 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.568 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.1 t80 -59.89 -35.34 74.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.5 m -75.35 -52.74 10.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.021 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HA ' ' OE1' ' A' ' 61' ' ' GLU . 4.3 tp10 -57.1 -43.96 82.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.692 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.56 HG23 HG21 ' A' ' 34' ' ' ILE . 72.9 t -64.87 -45.25 95.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.246 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -58.95 -41.08 86.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.21 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -58.99 -39.91 83.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.196 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.588 HD11 ' OG ' ' A' ' 30' ' ' SER . 4.9 mt -69.18 -61.84 1.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.578 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 4.2 m-30 -73.73 38.38 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.649 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -58.59 133.76 56.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.61 -42.0 3.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.881 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.464 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.5 OUTLIER -77.91 52.3 1.04 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.871 0.367 . . . . 0.0 110.773 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -58.75 -15.26 11.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.65 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.48 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.6 p30 -60.92 -40.12 91.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.581 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 17' ' ' ILE . 97.6 mt -72.12 -40.77 67.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.001 0.429 . . . . 0.0 110.364 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.401 HD21 ' HA ' ' A' ' 63' ' ' ALA . 2.0 mm? -57.47 -33.64 68.19 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.062 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.3 t -58.14 -40.47 81.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.247 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -72.59 -44.73 61.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.522 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.584 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 11.8 t80 -57.23 -40.43 77.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.802 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.079 -179.864 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.573 HG23 HD22 ' A' ' 35' ' ' LEU . 50.3 mm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.729 0.3 . . . . 0.0 110.853 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -50.73 -37.53 42.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.604 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 59.6 mtt -58.56 -39.35 80.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.015 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.584 HD23 ' HB1' ' A' ' 10' ' ' ALA . 20.3 mt -71.7 -46.59 58.27 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.485 ' CD2' HG22 ' B' ' 2' ' ' ILE . 4.1 mm? -57.03 -42.51 80.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.518 0.675 . . . . 0.0 109.406 178.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -69.43 -36.51 76.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.856 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.495 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -61.32 -44.91 96.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.591 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.455 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.61 -41.73 73.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.876 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.87 -38.82 89.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.661 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -56.47 -54.0 50.81 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.972 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.36 -43.48 81.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.539 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.119 179.617 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.686 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.612 HD13 ' CB ' ' B' ' 8' ' ' ALA . 31.5 mm -50.91 -44.25 26.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.614 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 t -53.94 -41.61 67.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.506 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 17' ' ' ILE . 29.2 t80 -65.77 -56.61 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.829 0.347 . . . . 0.0 111.088 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.7 t -58.26 -43.49 86.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.341 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -58.07 -55.4 35.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.885 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.52 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.63 -38.97 64.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.4 mt -61.23 -43.14 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.557 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -65.03 -56.46 12.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.751 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.52 HG22 ' HA ' ' A' ' 16' ' ' LYS . 12.2 t -59.53 -31.62 69.57 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.818 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.5 tpt85 -68.78 -56.93 6.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.92 0.391 . . . . 0.0 111.359 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.479 ' CD2' HG13 ' A' ' 27' ' ' ILE . 70.9 m-85 -93.43 38.94 1.05 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.209 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 19' ' ' THR . 75.8 mt -53.94 -35.22 61.5 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 110.837 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -75.13 -38.9 60.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.888 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -106.33 79.82 0.64 Allowed Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.541 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 24.1 Cg_endo -58.84 -37.72 92.32 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.901 2.401 . . . . 0.0 112.651 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -48.58 -33.74 10.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.218 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.487 HG23 HD22 ' A' ' 65' ' ' LEU . 5.2 mm -64.43 -48.91 83.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.782 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.504 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.0 t80 -57.54 -50.84 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.87 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -56.21 -51.58 67.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.37 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.553 ' CB ' HD11 ' A' ' 65' ' ' LEU . 51.5 m -50.27 -50.5 50.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.071 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.2 t80 -53.35 -47.03 69.74 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.159 0.504 . . . . 0.0 110.611 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.3 mt -59.91 -42.69 94.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.354 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -61.55 -31.69 71.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.015 178.75 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.691 HG22 HG13 ' A' ' 58' ' ' VAL . 78.0 mt -60.63 -58.19 8.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.42 . . . . 0.0 109.935 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.844 HD22 HG23 ' B' ' 2' ' ' ILE . 89.5 mt -60.33 -38.57 84.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.3 m-70 -58.98 -40.81 85.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.707 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.9 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.075 179.301 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 N--CA 1.463 0.179 0 CA-C-O 120.639 0.257 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.691 HG13 HG22 ' A' ' 34' ' ' ILE . 61.1 t -53.35 -41.43 44.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.744 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 16.7 t80 -60.83 -39.13 87.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.8 m -70.94 -47.92 56.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.719 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 5.1 mm-40 -57.7 -46.96 83.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 58' ' ' VAL . 68.6 t -64.3 -41.26 91.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.911 0.386 . . . . 0.0 110.0 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.78 -39.96 93.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.105 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -60.48 -41.19 93.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.217 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CB ' ' A' ' 30' ' ' SER . 4.7 mt -66.75 -64.27 0.89 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.361 0.601 . . . . 0.0 110.669 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.451 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.6 m-30 -76.31 42.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.138 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -57.86 134.22 56.12 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.452 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.94 -41.44 2.39 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.257 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -79.52 59.95 3.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.901 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -61.51 -6.05 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.113 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.607 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.0 p30 -61.5 -44.32 97.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.424 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.607 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 98.3 mt -72.62 -40.81 66.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.168 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 63' ' ' ALA . 1.0 OUTLIER -56.31 -35.83 68.0 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.206 179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 t -58.82 -39.94 82.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.468 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -70.57 -51.36 28.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.106 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.578 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 17.9 t80 -57.53 -39.6 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.133 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 CA-C-N 115.638 -0.71 . . . . 0.0 113.385 -179.384 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.844 HG23 HD22 ' A' ' 35' ' ' LEU . 41.2 mm . . . . . 0 CA--C 1.524 -0.05 0 CA-C-O 120.79 0.329 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -54.65 -47.06 74.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.04 179.644 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 61.6 mtt -59.18 -49.5 77.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.981 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.686 HD23 ' HB1' ' A' ' 10' ' ' ALA . 87.5 mt -61.44 -48.06 82.88 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.938 0.399 . . . . 0.0 111.021 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' ' 35' ' ' LEU . 48.5 tp -61.5 -38.15 86.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 3' ' ' GLN . 4.1 tm-20 -67.18 -39.15 86.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.089 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.612 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -51.25 -43.58 61.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.786 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -57.08 -43.28 81.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -62.12 -40.61 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.644 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -59.09 -53.53 57.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.637 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.3 mt -64.62 -49.91 69.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.179 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.829 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 120.842 0.353 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.741 HD13 ' HB1' ' B' ' 8' ' ' ALA . 42.6 mm -54.8 -40.52 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.226 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.0 m -55.13 -39.66 69.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.452 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.667 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 17.0 t80 -68.73 -55.5 11.15 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.969 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.35 -37.26 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.938 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -64.03 -56.53 14.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.71 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.74 -40.12 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.504 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.667 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 79.1 mt -62.37 -45.74 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.632 ' HB2' ' HZ2' ' A' ' 18' ' ' LYS . 3.6 ttmp? -63.01 -55.87 21.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 16' ' ' LYS . 11.8 t -58.8 -32.59 69.49 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.472 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -68.31 -57.36 6.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.375 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -91.62 37.38 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.459 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 43.6 mt -56.54 -33.2 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.847 0.356 . . . . 0.0 110.729 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -74.71 -36.95 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.657 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.421 ' HB3' HG12 ' A' ' 27' ' ' ILE . 93.7 m-70 -106.37 78.9 0.56 Allowed Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.797 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.44 -37.89 95.96 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.886 2.391 . . . . 0.0 112.677 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.95 -33.43 17.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.295 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.449 HG23 HD22 ' A' ' 65' ' ' LEU . 5.5 mm -64.49 -53.5 41.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.019 0.438 . . . . 0.0 110.814 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.623 ' CE2' HD11 ' A' ' 32' ' ' LEU . 45.1 t80 -60.5 -49.44 77.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.934 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.406 HH11 ' HG2' ' A' ' 29' ' ' ARG . 50.2 mmt-85 -52.67 -52.68 54.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.182 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 34' ' ' ILE . 61.9 m -53.83 -49.32 68.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.977 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.582 ' HA ' HD12 ' A' ' 34' ' ' ILE . 62.0 t80 -51.65 -50.29 60.64 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.926 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.623 HD11 ' CE2' ' A' ' 28' ' ' TYR . 36.1 mt -57.82 -44.73 86.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.117 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 95.2 mt-10 -62.68 -30.04 71.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.763 HG22 HG13 ' A' ' 58' ' ' VAL . 76.9 mt -60.95 -56.49 17.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.944 0.402 . . . . 0.0 110.241 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.857 ' HB2' HD13 ' B' ' 6' ' ' LEU . 49.5 mt -64.53 -41.72 96.19 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.621 0.724 . . . . 0.0 109.17 178.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.526 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.8 m-70 -55.84 -41.61 74.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.954 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 70.1 m . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.384 179.478 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 tp10 . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.494 0.188 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.763 HG13 HG22 ' A' ' 34' ' ' ILE . 88.8 t -53.4 -42.56 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.061 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.611 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 23.4 t80 -63.6 -38.94 93.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 89.6 m -68.47 -48.72 63.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.838 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.448 ' OE1' HG23 ' A' ' 34' ' ' ILE . 93.0 mt-10 -57.28 -45.87 83.65 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.825 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 58' ' ' VAL . 64.8 t -64.58 -40.78 90.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.785 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.85 -39.89 90.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.039 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -64.44 -41.04 96.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.661 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.3 mt -64.04 -64.16 0.96 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.268 0.556 . . . . 0.0 111.298 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.611 ' HB2' HD23 ' A' ' 73' ' ' LEU . 6.2 m-30 -74.48 40.25 0.13 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.768 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -59.0 131.57 51.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 110.296 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.23 -43.38 2.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.966 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -86.03 52.62 2.53 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.937 0.399 . . . . 0.0 110.525 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 94.9 mt-10 -64.6 0.88 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.013 -179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -61.49 -47.98 83.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.077 0.465 . . . . 0.0 109.96 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.06 -33.64 68.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.966 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.74 -43.23 68.93 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.676 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.8 t -54.36 -40.49 68.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.696 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 49.4 mt-10 -63.35 -46.32 87.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.451 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 13.4 t80 -57.72 -44.68 86.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.54 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.047 -179.826 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.759 HG23 HD22 ' A' ' 35' ' ' LEU . 40.2 mm . . . . . 0 C--O 1.227 -0.101 0 CA-C-O 120.449 0.166 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' GLN . . . . . 0.53 ' NE2' ' HG2' ' B' ' 4' ' ' MET . 1.8 pp0? -54.48 -35.05 62.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.655 0.264 . . . . 0.0 110.61 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' MET . . . . . 0.53 ' HG2' ' NE2' ' B' ' 3' ' ' GLN . 95.8 mmm -69.42 -45.82 68.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.649 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' B' ' 8' ' ' ALA . 20.2 tp -64.03 -49.2 73.33 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.936 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 35' ' ' LEU . 28.5 tp -59.86 -40.39 88.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.022 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -63.88 -37.3 86.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.741 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.6 -41.5 70.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.923 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.49 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -56.87 -46.22 81.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.72 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -59.03 -38.44 79.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.176 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.411 ' C ' ' H ' ' B' ' 13' ' ' GLU . 66.6 t80 -63.42 -44.47 94.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 11' ' ' ILE . 84.6 mt -75.86 24.7 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.715 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' B' ' 11' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.183 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.124 0.488 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.591 HD13 ' HB1' ' B' ' 8' ' ' ALA . 49.4 mm -52.57 -41.89 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.92 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.0 t -58.7 -37.64 76.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.191 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.632 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -63.26 -54.15 41.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.25 0.547 . . . . 0.0 109.741 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.468 HG11 ' HA ' ' B' ' 9' ' ' ALA . 53.1 t -60.36 -38.94 79.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.85 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -63.6 -47.28 82.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.391 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.521 ' HA ' HG22 ' A' ' 19' ' ' THR . 23.5 ttmm -63.28 -36.14 82.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.592 HG12 HD13 ' A' ' 72' ' ' LEU . 81.2 mt -64.66 -42.55 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.823 0.344 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 28.7 mtpp -62.29 -46.6 88.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 110.783 179.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.522 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -71.27 -29.45 65.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.529 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -67.14 -56.02 11.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.547 ' CD2' HG13 ' A' ' 27' ' ' ILE . 73.1 m-85 -95.48 42.09 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 19' ' ' THR . 77.9 mt -54.97 -36.6 65.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.331 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -75.66 -38.47 58.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.885 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -105.86 78.15 0.45 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.198 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.45 -33.65 93.8 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.75 2.3 . . . . 0.0 112.518 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -53.51 -30.21 40.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.547 HG13 ' CD2' ' A' ' 21' ' ' PHE . 6.9 mm -64.19 -51.95 62.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.837 0.351 . . . . 0.0 111.017 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.622 ' CE2' HD11 ' A' ' 32' ' ' LEU . 62.7 t80 -57.08 -46.1 82.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.823 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.503 HH11 ' HA ' ' A' ' 29' ' ' ARG . 3.8 mmm180 -55.68 -56.11 24.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.618 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.661 ' HB2' HD11 ' A' ' 65' ' ' LEU . 50.9 m -54.64 -49.88 69.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.21 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -49.15 -47.11 45.98 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.027 0.442 . . . . 0.0 110.825 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.622 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.0 mt -60.09 -40.69 90.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.555 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -63.4 -36.81 84.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.48 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.526 HG21 HG23 ' A' ' 62' ' ' VAL . 75.3 mt -60.07 -56.32 18.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.749 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.686 HD22 HG23 ' B' ' 2' ' ' ILE . 83.4 mt -59.02 -44.41 91.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.326 0.584 . . . . 0.0 109.468 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -54.96 -42.68 72.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.708 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.52 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.393 0.14 . . . . 0.0 111.364 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.616 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.5 t -56.91 -44.14 81.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 0.0 110.375 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.7 t80 -64.24 -37.93 89.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.724 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.9 m -65.47 -55.27 18.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.11 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 59.3 mm-40 -57.54 -46.5 83.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.526 HG23 HG21 ' A' ' 34' ' ' ILE . 85.8 t -64.0 -41.35 92.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.912 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.9 -41.09 95.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.14 0.495 . . . . 0.0 109.931 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -60.08 -44.56 94.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.553 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.661 HD11 ' HB2' ' A' ' 30' ' ' SER . 3.1 mt -63.17 -61.56 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.334 0.588 . . . . 0.0 110.605 179.003 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.425 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 6.4 m-30 -72.94 36.94 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.486 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 65' ' ' LEU . 29.5 tpt85 -59.6 129.46 42.03 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -36.14 2.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.371 -0.918 . . . . 0.0 111.553 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -78.28 42.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.836 0.35 . . . . 0.0 110.17 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.677 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 6.3 tt0 -53.99 -11.68 0.48 Allowed 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -60.69 -49.4 77.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.87 0.367 . . . . 0.0 110.074 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 17' ' ' ILE . 82.3 mt -72.49 -34.38 67.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.541 . . . . 0.0 110.058 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.912 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -52.04 -42.32 63.02 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.107 -179.652 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 t -56.87 -41.13 77.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.257 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -67.99 -46.63 70.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.034 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.4 t80 -58.35 -41.48 84.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.357 0 CA-C-N 115.421 -0.809 . . . . 0.0 114.069 -178.99 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.686 HG23 HD22 ' A' ' 35' ' ' LEU . 51.4 mm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.605 0.24 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -57.41 -33.85 68.31 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.1 mmt -59.15 -39.44 82.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.473 HD23 ' HB1' ' A' ' 10' ' ' ALA . 35.1 mt -72.14 -45.77 59.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.8 -42.72 80.01 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.453 0.645 . . . . 0.0 109.265 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.93 -37.19 72.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.154 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.591 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -62.65 -47.19 84.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.03 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.468 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.86 -43.21 76.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.321 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.64 -38.96 89.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.715 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.47 ' HD2' HD12 ' A' ' 11' ' ' ILE . 37.1 t80 -62.23 -54.95 33.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.746 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.413 HD21 ' CG2' ' A' ' 11' ' ' ILE . 95.5 mt -62.41 -51.33 67.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.627 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.909 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.25 0 CA-C-O 120.781 0.324 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.622 HD13 ' HB1' ' B' ' 8' ' ' ALA . 40.3 mm -53.35 -45.48 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.261 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -58.29 -35.37 71.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.114 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 38.7 t80 -63.35 -55.83 21.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.195 0.521 . . . . 0.0 109.815 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' B' ' 8' ' ' ALA . 36.9 t -60.73 -38.02 77.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.453 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.57 -41.08 96.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.691 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.502 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.4 ttmt -66.77 -38.72 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.125 0.488 . . . . 0.0 110.121 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 84.8 mt -62.11 -42.83 96.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.68 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -65.28 -54.78 24.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.641 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.6 t -59.64 -31.27 69.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.569 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -68.11 -52.42 35.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.115 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.616 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 78.2 m-85 -98.3 44.17 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.026 -179.322 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 85.2 mt -56.39 -42.41 77.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.854 0.359 . . . . 0.0 110.546 179.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -76.21 -23.72 54.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.157 0.503 . . . . 0.0 109.86 179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.616 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.3 m170 -108.99 73.06 0.5 Allowed Pre-proline 0 CA--C 1.535 0.366 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.351 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.39 -34.59 43.2 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.639 2.226 . . . . 0.0 112.46 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -53.91 -35.25 61.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.427 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.607 ' CG1' ' HB3' ' A' ' 24' ' ' HIS . 1.0 OUTLIER -64.29 -51.65 65.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.556 -179.697 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 54.9 t80 -56.9 -47.24 81.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.95 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -55.61 -54.6 42.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.277 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.554 ' O ' HG13 ' A' ' 34' ' ' ILE . 44.7 t -54.16 -48.12 71.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.606 ' HA ' HD12 ' A' ' 34' ' ' ILE . 49.0 t80 -52.33 -47.52 65.98 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.99 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 66.4 mt -60.09 -41.42 92.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 39.3 tt0 -63.77 -30.02 71.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.689 HG22 HG13 ' A' ' 58' ' ' VAL . 79.6 mt -62.47 -56.71 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.124 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.052 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.749 HD22 HG23 ' B' ' 2' ' ' ILE . 78.3 mt -61.82 -36.26 80.64 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.5 0.667 . . . . 0.0 109.232 178.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 5.1 m-70 -59.95 -48.06 83.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.901 179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.5 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.239 179.121 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 . . . . . 0 N--CA 1.461 0.09 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 34' ' ' ILE . 44.6 t -52.94 -43.11 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.639 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 40.2 t80 -61.15 -36.88 80.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.875 0.369 . . . . 0.0 110.302 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.408 HG22 ' OD1' ' A' ' 64' ' ' ASN . 88.1 m -71.79 -48.39 46.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.475 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -56.78 -48.07 78.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.932 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.56 -41.85 93.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.068 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.663 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.7 -39.03 83.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.85 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.408 ' OD1' HG22 ' A' ' 60' ' ' THR . 22.6 m120 -63.91 -37.98 89.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.347 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 30' ' ' SER . 5.8 mt -70.56 -66.28 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.512 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.561 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.0 m-30 -74.55 38.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.087 -178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -66.4 138.49 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.549 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.31 -44.53 2.79 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.527 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.523 ' C ' ' H ' ' A' ' 71' ' ' ASP . 0.7 OUTLIER -68.47 -62.95 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.82 0.343 . . . . 0.0 110.573 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.6 mt-10 59.98 -15.94 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.523 ' H ' ' C ' ' A' ' 69' ' ' GLN . 34.4 t70 -61.99 -49.17 77.15 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-O 121.096 0.474 . . . . 0.0 109.897 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.3 mt -68.84 -36.35 78.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.834 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.664 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -54.59 -39.35 67.74 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.68 179.858 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.4 t -55.44 -41.96 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.738 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.66 -42.77 77.44 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.539 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.626 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 20.1 t80 -57.28 -44.22 83.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.846 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.59 -179.969 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 35' ' ' LEU . 48.1 mm . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 120.649 0.262 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -55.4 -58.13 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.485 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -79.77 -27.99 40.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' B' ' 2' ' ' ILE . 0.9 OUTLIER -58.87 -45.95 88.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.845 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.729 HD13 ' HB2' ' A' ' 35' ' ' LEU . 43.1 tp -77.77 -44.46 27.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 tp10 -56.52 -33.16 65.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.653 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.622 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.71 -41.95 82.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.357 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.48 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.47 -47.68 78.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.442 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.98 -38.88 83.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -59.53 -54.77 42.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.849 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.87 -48.83 80.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.903 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 12.5 pt-20 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.723 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.235 0.332 0 CA-C-O 120.925 0.393 . . . . 0.0 110.278 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.506 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.4 mm -53.79 -42.76 53.7 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.416 179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 m -55.58 -37.97 68.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.823 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.553 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.9 t80 -64.84 -58.08 7.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.847 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.541 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.6 t -58.88 -45.09 91.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.396 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -61.07 -54.58 42.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.042 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.455 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.8 tttt -53.64 -37.42 63.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.197 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.607 HG12 HD13 ' A' ' 72' ' ' LEU . 95.5 mt -64.84 -37.26 79.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.002 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -65.54 -47.59 75.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.426 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.3 t -70.98 -26.99 63.39 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.754 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HG2' HD11 ' A' ' 72' ' ' LEU . 19.5 tpp180 -64.77 -58.07 7.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.318 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.794 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 61.6 m-85 -94.89 46.42 1.13 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.427 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.5 mt -55.45 -40.74 71.96 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.811 0.338 . . . . 0.0 110.796 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.38 -19.35 46.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.094 0.473 . . . . 0.0 110.156 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.794 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 58.1 m170 -110.33 74.06 0.82 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.354 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.72 -35.61 56.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.589 2.193 . . . . 0.0 112.55 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -52.17 -36.47 51.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.639 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.46 -48.35 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 110.701 -179.738 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.619 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 55.3 t80 -56.92 -51.36 69.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.118 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 29' ' ' ARG . 21.5 mmt85 -56.9 -54.29 48.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.493 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 57.0 m -52.85 -49.56 65.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.626 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.9 t80 -53.54 -49.81 66.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 110.959 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.633 HD22 ' HB2' ' B' ' 9' ' ' ALA . 41.2 mt -58.1 -39.78 79.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.161 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.59 -29.53 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.201 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.685 HD11 HD12 ' A' ' 65' ' ' LEU . 82.9 mt -61.75 -59.53 4.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.57 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.801 HD22 HG23 ' B' ' 2' ' ' ILE . 86.3 mt -60.3 -38.79 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -59.74 -42.79 93.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.242 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.3 m . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.371 179.295 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.581 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.8 t -52.63 -40.68 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.396 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.49 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 22.5 t80 -60.38 -40.22 90.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.561 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.3 m -73.59 -44.8 56.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.407 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.663 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -57.29 -47.77 80.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.232 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.66 -42.93 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.947 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -62.21 -44.81 95.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.134 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.663 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -64.12 -40.87 97.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.87 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.685 HD12 HD11 ' A' ' 34' ' ' ILE . 3.2 mt -60.98 -61.0 2.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.829 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.461 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 6.6 m-30 -72.95 38.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.826 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.2 ttm-85 -60.2 127.88 34.01 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.49 -43.23 2.78 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.802 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -86.43 49.84 1.88 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.94 0.4 . . . . 0.0 110.453 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.8 mt-10 -60.63 -8.52 2.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.732 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -61.16 -45.68 93.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.93 0.395 . . . . 0.0 109.942 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.607 HD13 HG12 ' A' ' 17' ' ' ILE . 94.4 mt -72.15 -32.63 67.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.919 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.947 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.28 -42.53 73.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.738 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 44.3 t -53.79 -39.94 65.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.234 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -68.0 -41.53 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.608 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 12.4 t80 -56.54 -43.55 79.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.246 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.26 179.553 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.801 HG23 HD22 ' A' ' 35' ' ' LEU . 37.7 mm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.857 0.361 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 13.5 tm0? -51.64 -35.13 40.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.233 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 24.9 mmt -63.14 -50.39 70.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.591 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.723 HD23 ' HB1' ' A' ' 10' ' ' ALA . 81.9 mt -65.95 -46.91 76.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' ' 35' ' ' LEU . 41.4 tp -61.17 -47.22 87.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.27 -35.51 80.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.418 . . . . 0.0 110.184 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.541 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -52.98 -38.57 62.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.917 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.633 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -57.66 -48.27 79.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.134 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.6 -38.73 91.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.629 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -57.94 -54.24 49.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.55 -49.55 70.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.221 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.889 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.552 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.742 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.6 mm -53.15 -43.06 48.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.046 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -57.15 -38.47 73.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.028 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.592 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 25.1 t80 -63.88 -55.97 18.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.088 0.47 . . . . 0.0 110.768 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.9 t -57.1 -45.0 84.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.378 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -57.69 -56.32 23.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.111 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.2 tttt -52.99 -36.53 60.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.518 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.592 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 76.9 mt -64.19 -41.12 91.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.268 179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -64.17 -55.48 21.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.507 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.3 t -59.22 -31.18 68.81 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.396 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH2' ' HG3' ' A' ' 69' ' ' GLN . 10.8 tpt180 -68.11 -56.09 10.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.909 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 27' ' ' ILE . 55.8 m-85 -93.98 41.31 1.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.989 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.0 mt -56.96 -35.36 69.03 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.996 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -74.95 -39.95 61.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.021 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -107.74 77.24 0.61 Allowed Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.356 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.99 -33.74 95.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.593 2.195 . . . . 0.0 112.395 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -51.2 -34.11 30.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.491 HG21 ' CE2' ' A' ' 21' ' ' PHE . 3.8 mm -64.37 -45.99 94.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.167 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 59.8 t80 -58.82 -49.39 77.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -56.24 -55.49 32.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.466 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.553 ' O ' HG13 ' A' ' 34' ' ' ILE . 18.5 p -53.02 -49.01 67.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.325 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.557 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.8 t80 -51.2 -45.25 61.78 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.878 0.37 . . . . 0.0 110.435 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 64.9 mt -62.93 -49.51 74.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -53.65 -29.39 38.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.481 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.696 HG22 HG13 ' A' ' 58' ' ' VAL . 84.3 mt -61.26 -49.62 83.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.104 0.478 . . . . 0.0 110.135 179.039 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.762 HD22 HG23 ' B' ' 2' ' ' ILE . 58.2 mt -66.15 -40.97 90.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -38.86 84.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.21 178.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.621 178.921 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.595 0.236 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.696 HG13 HG22 ' A' ' 34' ' ' ILE . 66.9 t -57.96 -43.15 84.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.984 0.421 . . . . 0.0 110.513 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.635 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.3 t80 -62.86 -39.44 94.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.944 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -66.14 -49.67 66.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -57.33 -45.29 84.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.016 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 58' ' ' VAL . 80.7 t -64.48 -40.83 90.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.054 179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.89 -41.66 98.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.098 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -62.01 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.532 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.604 HD12 HD11 ' A' ' 34' ' ' ILE . 5.8 mt -67.64 -65.06 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.431 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.525 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 5.9 m-30 -73.43 38.86 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.638 -179.071 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -58.76 132.62 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.23 -43.32 3.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.791 -178.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.8 OUTLIER -79.93 51.23 1.3 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.81 0.338 . . . . 0.0 110.587 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.1 mt-10 -61.72 -4.33 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.051 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.72 -50.61 71.75 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.964 0.411 . . . . 0.0 110.066 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.58 -36.28 73.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.981 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.92 -40.85 70.29 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.64 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.9 t -56.3 -40.35 74.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.562 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.29 -38.91 71.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.088 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.635 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.6 t80 -57.51 -43.24 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.005 0.431 . . . . 0.0 110.233 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.364 179.647 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.762 HG23 HD22 ' A' ' 35' ' ' LEU . 40.6 mm . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.721 0.296 . . . . 0.0 111.057 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.41 -34.34 64.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.511 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 45.8 ttm -63.26 -49.92 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.256 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.552 HD23 ' HB1' ' A' ' 10' ' ' ALA . 68.6 mt -68.46 -46.72 69.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.955 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.462 HD13 ' HB2' ' A' ' 35' ' ' LEU . 63.0 tp -56.85 -44.46 82.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.556 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -68.27 -39.58 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.615 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.742 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.67 -40.49 79.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.15 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.438 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -61.9 -40.65 96.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.279 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -64.01 -44.22 93.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.793 0.33 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -64.05 -58.67 5.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.473 0.654 . . . . 0.0 110.776 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.414 HD13 HG23 ' A' ' 11' ' ' ILE . 21.2 tp -57.95 -36.97 73.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.43 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.922 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.308 0 CA-C-O 120.846 0.355 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.744 HD13 ' HB1' ' B' ' 8' ' ' ALA . 47.0 mm -51.75 -47.15 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.373 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -55.54 -36.61 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.183 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.577 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 26.5 t80 -62.46 -54.27 42.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.191 0.519 . . . . 0.0 109.68 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' B' ' 9' ' ' ALA . 61.2 t -57.75 -40.12 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.542 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.64 -53.03 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.437 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 61.3 tttp -58.14 -36.72 73.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.937 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 13' ' ' TYR . 89.1 mt -61.43 -38.47 80.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.987 0.422 . . . . 0.0 110.286 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 29.6 mtpp -64.55 -45.22 88.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.255 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.605 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -74.83 -28.66 60.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.909 -179.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.51 -56.47 15.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.974 0.416 . . . . 0.0 111.143 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.663 ' CD2' HG13 ' A' ' 27' ' ' ILE . 50.6 m-85 -97.11 48.21 1.05 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.3 mt -52.71 -40.46 63.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.692 0.282 . . . . 0.0 111.111 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -77.31 -27.32 52.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.189 0.519 . . . . 0.0 110.036 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 63.6 m170 -109.76 73.41 0.66 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.735 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -65.82 -32.71 45.62 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.311 2.007 . . . . 0.0 112.126 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -54.91 -32.09 60.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.512 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.663 HG13 ' CD2' ' A' ' 21' ' ' PHE . 2.4 mm -63.81 -48.53 85.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.958 0.409 . . . . 0.0 110.345 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.569 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.8 t80 -56.81 -48.98 76.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.532 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -56.95 -54.9 41.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.452 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.569 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.9 m -53.05 -46.43 68.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.934 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.436 ' HA ' HD12 ' A' ' 34' ' ' ILE . 43.7 t80 -52.63 -48.07 66.63 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.002 0.429 . . . . 0.0 110.699 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 48.9 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.284 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.545 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.0 mm-40 -61.68 -31.79 71.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.18 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 30' ' ' SER . 68.0 mt -62.23 -55.81 21.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.429 . . . . 0.0 109.898 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.835 ' HB2' HD13 ' B' ' 6' ' ' LEU . 43.1 mt -60.58 -39.69 88.96 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.545 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -58.07 -42.83 86.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.596 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.4 m . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.307 179.306 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.497 ' O ' ' HB ' ' A' ' 60' ' ' THR . 29.9 tt0 . . . . . 0 N--CA 1.46 0.048 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.479 ' O ' HG23 ' A' ' 62' ' ' VAL . 97.5 t -53.38 -44.78 55.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.98 0.419 . . . . 0.0 110.294 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.5 t80 -61.34 -30.75 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.271 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 58.5 m -66.76 -62.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.399 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 57' ' ' GLU . 8.8 mp0 -57.06 -41.46 78.77 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 58' ' ' VAL . 99.3 t -63.65 -44.34 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.729 0.3 . . . . 0.0 110.428 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.702 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.29 -41.67 97.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 0.0 109.986 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -62.31 -41.96 98.97 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.844 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 34' ' ' ILE . 4.7 mt -63.51 -64.05 1.01 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.412 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.501 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.3 m-30 -73.61 38.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.613 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -62.72 130.68 46.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.825 0.345 . . . . 0.0 110.201 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.07 -44.3 3.11 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.72 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -86.54 54.8 3.29 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.038 0.447 . . . . 0.0 110.309 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.455 ' OE1' ' HA ' ' A' ' 70' ' ' GLU . 4.8 mm-40 -60.73 -3.76 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.493 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.1 -50.29 73.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.909 0.385 . . . . 0.0 110.587 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.529 HD13 HG12 ' A' ' 17' ' ' ILE . 85.9 mt -68.02 -36.1 79.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.21 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.702 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.37 -37.71 65.29 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.74 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.0 t -56.74 -42.28 79.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.47 -41.08 76.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.619 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.9 t80 -57.0 -43.25 81.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.338 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.948 -179.958 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.829 HG23 HD22 ' A' ' 35' ' ' LEU . 40.1 mm . . . . . 0 N--CA 1.458 -0.046 0 CA-C-O 120.548 0.213 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -49.92 -39.3 39.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.318 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 56.7 mtm -71.14 -42.62 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.059 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.576 HD11 ' HD2' ' A' ' 13' ' ' TYR . 22.6 tp -65.33 -53.11 48.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.403 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.835 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.7 tp -57.85 -39.3 77.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 109.911 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -66.02 -36.64 83.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.744 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.44 -42.47 82.51 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.172 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.99 -45.85 78.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.995 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -59.46 -38.3 80.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.306 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.457 ' HD2' HD12 ' A' ' 11' ' ' ILE . 45.6 t80 -58.93 -54.99 40.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.306 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.86 -43.46 98.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.143 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' B' ' 9' ' ' ALA . 56.1 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.94 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.824 0.345 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.558 HD13 ' CB ' ' B' ' 8' ' ' ALA . 35.0 mm -51.93 -45.52 40.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.095 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 92.9 p -56.97 -38.7 73.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.164 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.57 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 t80 -62.77 -54.8 33.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.961 0.41 . . . . 0.0 110.665 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.604 HG11 ' HA ' ' B' ' 9' ' ' ALA . 44.6 t -56.94 -39.85 68.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.99 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -58.44 -55.47 34.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.539 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 12' ' ' SER . 27.2 mtpp -53.03 -37.67 61.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.2 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' HD1' ' A' ' 21' ' ' PHE . 80.0 mt -62.02 -40.23 86.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.139 0.495 . . . . 0.0 110.231 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' B' ' 12' ' ' LEU . 41.3 ttmt -66.73 -54.0 27.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.902 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -62.91 -32.27 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.87 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HG2' HH11 ' A' ' 20' ' ' ARG . 12.2 tpp85 -69.24 -49.15 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.072 0.463 . . . . 0.0 110.924 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 27' ' ' ILE . 17.8 m-85 -92.64 40.86 1.06 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.816 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 19' ' ' THR . 38.3 mt -61.56 -35.87 79.01 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.04 -37.97 61.56 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.976 0.417 . . . . 0.0 110.482 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CG1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -115.44 74.57 4.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.065 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.29 -29.78 80.42 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.575 2.183 . . . . 0.0 111.908 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -52.03 -30.98 27.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.813 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 21' ' ' PHE . 1.6 mm -63.77 -39.55 85.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.301 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.587 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 68.2 t80 -56.44 -48.14 77.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.578 HH11 ' HA ' ' A' ' 29' ' ' ARG . 4.2 mmm180 -56.51 -57.41 12.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.799 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.511 ' O ' HG13 ' A' ' 34' ' ' ILE . 32.5 p -48.82 -48.73 41.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.467 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.7 t80 -51.7 -47.41 63.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.071 0.462 . . . . 0.0 110.637 178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 49.2 mt -58.61 -40.95 84.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.139 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 57.6 mm-40 -63.24 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.051 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.77 HD11 HD12 ' A' ' 65' ' ' LEU . 53.1 mt -62.9 -56.85 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-O 120.96 0.41 . . . . 0.0 110.244 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.709 HD22 HG23 ' B' ' 2' ' ' ILE . 72.1 mt -59.81 -37.3 78.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 5.3 m-70 -62.29 -41.62 98.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.573 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m . . . . . 0 CA--C 1.52 -0.194 0 CA-C-O 121.194 0.521 . . . . 0.0 109.853 179.109 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 . . . . . 0 N--CA 1.462 0.132 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.528 HG13 HG22 ' A' ' 34' ' ' ILE . 46.8 t -52.73 -44.12 46.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.165 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.582 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.2 t80 -62.41 -36.01 81.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -72.07 -50.97 23.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.937 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.422 ' HA ' ' OE1' ' A' ' 61' ' ' GLU . 4.6 tp10 -58.44 -45.79 87.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.01 -179.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.565 HG23 HG21 ' A' ' 34' ' ' ILE . 94.3 t -64.45 -43.03 96.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.627 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.45 -42.18 95.62 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.15 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -59.2 -39.73 83.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.321 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.77 HD12 HD11 ' A' ' 34' ' ' ILE . 6.5 mt -68.49 -64.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.286 179.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 3.7 m-30 -74.18 41.65 0.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.65 -178.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -62.18 137.55 58.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.867 0.365 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.09 -45.01 3.25 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.323 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -88.02 52.88 2.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.064 0.459 . . . . 0.0 110.491 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.6 mt-10 -67.75 6.23 0.7 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.266 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -61.64 -48.98 78.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.174 0.511 . . . . 0.0 110.056 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.4 mt -72.32 -34.3 67.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.222 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.627 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.98 -38.16 64.73 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.993 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -55.11 -42.61 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.741 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.55 -45.84 78.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.592 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.582 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.7 t80 -57.54 -44.13 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.421 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.266 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.709 -179.212 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.709 HG23 HD22 ' A' ' 35' ' ' LEU . 46.2 mm . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.599 0.238 . . . . 0.0 111.443 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -52.59 -35.98 55.23 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 66.1 mtt -65.15 -47.33 77.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.528 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.513 HD23 ' HB1' ' A' ' 10' ' ' ALA . 80.2 mt -69.78 -45.7 67.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.959 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 56.0 tp -57.41 -44.35 84.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -72.53 -38.48 68.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.786 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.558 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.45 -41.77 77.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.209 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.604 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.05 -43.24 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.971 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.67 -38.04 89.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.428 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.429 ' CD2' HD12 ' A' ' 11' ' ' ILE . 42.0 t80 -57.13 -55.44 34.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.472 ' HB3' ' NZ ' ' A' ' 18' ' ' LYS . 95.9 mt -64.42 -49.29 72.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.526 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.196 179.683 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.755 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.932 0.396 . . . . 0.0 111.048 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.529 HD13 ' CB ' ' B' ' 8' ' ' ALA . 32.6 mm -52.94 -45.3 51.45 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.081 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.319 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -57.44 -36.25 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.191 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.514 ' O ' HG13 ' A' ' 17' ' ' ILE . 10.1 t80 -65.97 -53.16 42.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -59.04 -44.24 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.499 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.78 -59.9 4.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.197 0.522 . . . . 0.0 111.198 -179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.3 tttt -53.48 -38.63 63.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.711 -179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.2 mt -62.37 -40.6 88.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.965 0.412 . . . . 0.0 110.214 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -63.91 -58.27 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -58.16 -31.45 67.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.475 -179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 tpt85 -64.74 -57.59 8.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.383 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.512 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.0 m-85 -92.98 40.66 1.06 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.392 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 62.9 mt -54.59 -34.77 62.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -75.26 -39.22 60.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -105.72 78.87 0.48 Allowed Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.401 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.451 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 21.4 Cg_endo -59.26 -35.3 97.48 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.726 2.284 . . . . 0.0 112.46 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -50.8 -31.42 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.422 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.512 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.4 mm -64.27 -46.77 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 0.0 110.646 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 32' ' ' LEU . 51.4 t80 -56.76 -49.97 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.043 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.67 -53.39 58.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.719 -179.699 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.9 m -51.89 -51.7 55.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.451 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -52.06 -49.0 64.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.053 0.454 . . . . 0.0 111.119 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 80.4 mt -61.8 -42.13 98.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.7 mm-40 -61.03 -34.3 74.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.358 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.661 HG22 HG13 ' A' ' 58' ' ' VAL . 86.4 mt -61.99 -60.64 2.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.175 0.512 . . . . 0.0 110.45 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.468 HD23 HG11 ' A' ' 58' ' ' VAL . 89.8 mt -57.93 -37.97 75.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.635 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.47 -43.34 99.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.13 179.702 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-O 121.144 0.497 . . . . 0.0 110.406 179.72 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 . . . . . 0 CA--C 1.522 -0.101 0 CA-C-O 120.723 0.296 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.661 HG13 HG22 ' A' ' 34' ' ' ILE . 37.6 t -53.25 -44.37 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.159 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.1 t80 -59.96 -37.81 80.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.326 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.7 m -72.31 -51.1 22.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.721 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -58.28 -48.17 81.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.485 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.554 HG23 HG21 ' A' ' 34' ' ' ILE . 95.4 t -64.12 -42.12 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.887 0.375 . . . . 0.0 110.237 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.811 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.13 -40.1 92.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.019 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -58.79 -40.45 84.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.457 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.533 HD11 ' CB ' ' A' ' 30' ' ' SER . 6.1 mt -68.29 -62.85 1.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.122 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HB2' HD22 ' A' ' 73' ' ' LEU . 5.1 m-30 -74.82 41.41 0.16 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.669 -179.224 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -64.02 133.47 53.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.718 0.294 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.34 -42.09 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.242 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -81.03 56.0 2.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 54.4 mt-10 -60.01 -4.57 0.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.073 -179.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.38 -53.82 51.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.939 0.4 . . . . 0.0 110.244 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.1 mt -71.56 -33.64 69.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.417 0.627 . . . . 0.0 109.509 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -53.85 -38.72 64.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.996 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -57.8 -42.23 83.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.929 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.71 -53.95 46.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.491 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.2 t80 -58.74 -38.97 79.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.2 0.524 . . . . 0.0 110.868 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.377 0 CA-C-N 115.396 -0.82 . . . . 0.0 114.111 -178.611 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 32.1 mm . . . . . 0 CA--C 1.53 0.194 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.089 0.471 . . . . 0.0 109.816 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 60.2 mtm -59.12 -41.88 89.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.523 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.755 HD23 ' HB1' ' A' ' 10' ' ' ALA . 54.9 mt -71.02 -46.27 62.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.513 HD11 ' N ' ' A' ' 36' ' ' HIS . 3.3 mm? -57.5 -42.66 83.16 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.287 0.565 . . . . 0.0 109.77 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.34 -40.08 85.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.918 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.529 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.42 -46.13 83.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.584 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.425 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.5 -43.47 79.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -39.3 93.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.72 -57.73 9.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.494 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.77 -47.87 84.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.347 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.865 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.815 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.909 0.385 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.759 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.7 mm -53.75 -44.18 58.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.324 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.4 p -56.44 -36.21 68.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.01 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.1 t80 -66.9 -55.54 14.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.887 0.375 . . . . 0.0 110.841 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.0 t -60.0 -44.52 94.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.3 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -60.39 -53.88 52.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.957 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.428 ' O ' HG22 ' A' ' 19' ' ' THR . 87.7 tttt -53.72 -38.52 64.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.94 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 13' ' ' TYR . 90.0 mt -61.39 -36.59 74.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.807 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.551 ' NZ ' ' HB2' ' A' ' 18' ' ' LYS . 5.2 ttmp? -64.8 -51.87 59.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.83 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -67.43 -29.3 68.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.646 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -64.54 -62.05 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.573 ' CD2' HG13 ' A' ' 27' ' ' ILE . 49.1 m-85 -94.83 44.66 1.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.849 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -53.53 -35.99 61.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 111.063 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -75.19 -35.91 61.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.096 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.425 ' HB3' HG12 ' A' ' 27' ' ' ILE . 92.5 m-70 -106.15 78.56 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.365 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.48 -34.52 98.13 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.82 2.347 . . . . 0.0 112.417 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -51.79 -32.46 31.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.692 HG23 HD22 ' A' ' 65' ' ' LEU . 10.4 mm -64.5 -48.96 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.457 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 61.6 t80 -58.44 -50.01 75.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.995 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -59.53 -56.65 19.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.343 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.632 ' O ' HG13 ' A' ' 34' ' ' ILE . 46.8 t -44.81 -51.91 9.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.528 -179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.9 t80 -50.36 -47.11 56.24 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.085 0.469 . . . . 0.0 110.779 179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' B' ' 9' ' ' ALA . 52.0 mt -63.26 -38.9 92.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.07 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.2 tp10 -64.69 -30.26 71.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.833 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.632 HG13 ' O ' ' A' ' 30' ' ' SER . 56.3 mt -63.78 -58.21 8.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.072 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.496 HD22 HG23 ' B' ' 2' ' ' ILE . 79.1 mt -57.44 -36.25 71.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 2.2 m-70 -62.01 -48.27 81.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.4 m . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 179.952 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 . . . . . 0 N--CA 1.461 0.111 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.512 HG13 HG22 ' A' ' 34' ' ' ILE . 50.5 t -52.78 -43.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.172 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 28.5 t80 -62.22 -36.14 81.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.601 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -72.84 -51.64 18.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.038 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.507 ' CD ' HG12 ' A' ' 34' ' ' ILE . 74.9 tt0 -57.8 -45.11 86.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.884 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.588 HG23 HG21 ' A' ' 34' ' ' ILE . 98.7 t -64.27 -42.74 96.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.799 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.83 -41.93 92.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.116 178.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -60.38 -39.94 89.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.232 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.692 HD22 HG23 ' A' ' 27' ' ' ILE . 1.2 mt -62.93 -64.99 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.909 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 15.1 m-30 -74.76 42.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.812 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 -59.18 129.64 43.09 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.59 -42.5 2.94 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.901 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.6 OUTLIER -81.52 50.5 1.49 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.811 0.338 . . . . 0.0 110.527 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.541 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 51.2 mt-10 -61.6 -1.15 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.47 -47.79 84.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.109 0.48 . . . . 0.0 110.422 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.0 mt -71.98 -35.39 69.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.267 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.799 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.05 -39.85 66.6 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.157 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.7 t -54.59 -41.06 69.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.943 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -70.2 -45.35 66.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.597 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 21.3 t80 -57.14 -45.32 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.275 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.175 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.865 -179.624 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.496 HG23 HD22 ' A' ' 35' ' ' LEU . 24.7 mm . . . . . 0 CA--C 1.527 0.078 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' B' ' 4' ' ' MET . 7.2 pt20 -56.77 -36.5 69.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.036 0.446 . . . . 0.0 110.233 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' MET . . . . . 0.573 ' N ' ' HG3' ' B' ' 3' ' ' GLN . 18.1 ptt? -62.82 -46.15 89.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.452 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.815 HD23 ' HB1' ' A' ' 10' ' ' ALA . 85.0 mt -68.93 -43.76 74.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.16 0.505 . . . . 0.0 110.358 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.7 tp -60.99 -44.57 97.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.612 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -73.38 -35.17 65.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.644 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.759 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.11 -39.99 66.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.214 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -59.13 -43.0 91.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.384 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.22 -50.67 72.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.946 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -59.24 -58.16 9.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.339 0.59 . . . . 0.0 111.163 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 21.9 tp -55.65 -39.17 70.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.699 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.804 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-O 120.979 0.419 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.923 HG23 HD11 ' B' ' 12' ' ' LEU . 50.2 mm -51.29 -48.23 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.444 -179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.1 p -55.33 -36.5 66.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.104 -179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -62.2 -49.32 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.034 0.445 . . . . 0.0 109.942 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.462 HG11 ' HA ' ' B' ' 9' ' ' ALA . 24.4 t -66.28 -37.69 80.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.87 -44.44 89.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.335 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HA ' HG22 ' A' ' 19' ' ' THR . 53.9 tttp -66.99 -40.09 87.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.908 0.385 . . . . 0.0 110.701 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.537 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 80.1 mt -60.81 -43.06 94.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 39.1 ttpt -65.44 -54.62 25.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.88 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.607 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -60.0 -29.37 68.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.317 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 20' ' ' ARG . 13.1 tpp85 -65.43 -56.99 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.171 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.5 m-85 -94.94 43.11 1.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.079 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 19' ' ' THR . 70.3 mt -55.4 -34.97 64.84 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.844 0.355 . . . . 0.0 110.921 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -74.66 -38.68 62.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.488 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -105.77 78.16 0.45 Allowed Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.22 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.91 -30.69 93.78 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.655 2.237 . . . . 0.0 112.266 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -52.58 -34.01 48.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.586 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.5 mm -64.76 -48.47 84.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.455 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 11.1 t80 -57.95 -57.24 13.66 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.063 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.847 HH21 HD12 ' A' ' 32' ' ' LEU . 2.0 mmp_? -50.12 -54.47 20.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.311 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 34' ' ' ILE . 69.4 m -53.57 -51.42 63.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.565 -179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.53 ' HA ' HD12 ' A' ' 34' ' ' ILE . 37.5 t80 -53.21 -51.01 63.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.965 0.412 . . . . 0.0 110.916 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.847 HD12 HH21 ' A' ' 29' ' ' ARG . 38.8 mt -59.81 -37.18 78.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.103 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 5.0 mm-40 -66.18 -31.27 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.805 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 30' ' ' SER . 82.8 mt -61.61 -56.73 15.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.459 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.682 HD22 HG23 ' B' ' 2' ' ' ILE . 73.2 mt -60.25 -39.15 85.74 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.14 -38.7 87.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.169 178.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 76.1 m . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.362 179.263 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 21.8 tt0 . . . . . 0 N--CA 1.456 -0.175 0 CA-C-O 120.401 0.143 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.578 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 46.7 t -55.46 -45.59 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.038 0.447 . . . . 0.0 110.357 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.589 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 29.0 t80 -65.75 -41.9 91.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.668 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.3 m -62.46 -48.5 79.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.936 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.712 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -59.03 -52.45 65.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.639 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.01 -45.33 94.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.394 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.793 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.4 -43.75 98.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.536 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.712 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 2.0 p30 -61.65 -38.68 88.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.84 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.503 HD22 HG23 ' A' ' 27' ' ' ILE . 1.8 mt -61.33 -63.27 1.34 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.631 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.5 m-30 -75.87 43.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.473 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.3 tpt180 -59.88 136.83 58.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.805 0.336 . . . . 0.0 110.662 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.73 -45.12 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.98 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -85.05 55.91 3.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.969 0.414 . . . . 0.0 110.407 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.13 -0.31 2.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.13 -43.73 98.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 110.733 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.31 -36.46 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.373 0.606 . . . . 0.0 110.353 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.793 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.4 OUTLIER -56.13 -36.83 68.68 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.268 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.3 t -53.12 -41.18 64.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.594 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -73.01 -39.82 65.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.835 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.642 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.2 t80 -57.18 -43.18 82.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.811 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.231 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.923 -179.864 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.682 HG23 HD22 ' A' ' 35' ' ' LEU . 43.9 mm . . . . . 0 N--CA 1.458 -0.07 0 CA-C-O 120.776 0.322 . . . . 0.0 110.736 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -54.97 -39.67 69.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 57.5 mtp -64.58 -48.37 75.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.483 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.76 HD23 ' HB1' ' A' ' 10' ' ' ALA . 83.9 mt -65.89 -45.88 80.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.961 0.41 . . . . 0.0 110.671 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.02 -48.29 82.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -64.1 -36.2 83.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.268 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.616 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -56.4 -50.63 71.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.558 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -46.55 -44.9 18.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.214 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.14 -39.72 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.064 0.459 . . . . 0.0 110.479 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.54 ' HD2' HD12 ' B' ' 12' ' ' LEU . 74.2 t80 -60.29 -51.43 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.517 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.923 HD11 HG23 ' A' ' 11' ' ' ILE . 6.5 mp -63.13 -48.67 77.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.681 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 16.9 pt-20 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.918 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.099 0.476 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.59 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.0 mm -52.75 -45.21 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.127 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.7 p -57.93 -35.28 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.7 t80 -62.86 -51.91 65.18 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -62.07 -42.03 93.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.416 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -60.41 -44.72 95.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.35 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 62.3 tttp -67.79 -40.32 83.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.778 0.323 . . . . 0.0 110.607 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.4 mt -59.93 -40.96 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.306 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.24 -56.35 17.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.708 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.5 t -62.36 -29.5 70.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.85 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 tpt85 -65.91 -60.12 3.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.816 0.341 . . . . 0.0 111.309 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.8 m-85 -92.25 41.61 1.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.105 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.8 mt -53.49 -35.03 60.15 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.841 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -37.48 60.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.027 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.63 78.17 0.53 Allowed Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.271 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -58.95 -36.32 97.04 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.726 2.284 . . . . 0.0 112.528 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -50.5 -31.0 14.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.266 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 21' ' ' PHE . 10.2 mm -64.33 -48.01 87.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.133 0.492 . . . . 0.0 110.471 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.624 ' CE2' HD11 ' A' ' 32' ' ' LEU . 57.6 t80 -62.64 -48.79 77.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.133 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -54.98 -54.81 38.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.561 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.714 ' HB3' HD11 ' A' ' 65' ' ' LEU . 47.5 t -54.06 -44.11 70.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.821 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.462 ' HA ' HD12 ' A' ' 34' ' ' ILE . 60.3 t80 -55.26 -46.4 76.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.909 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.624 HD11 ' CE2' ' A' ' 28' ' ' TYR . 69.6 mt -62.81 -47.25 84.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.898 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 30' ' ' SER . 24.6 pt-20 -62.69 -24.48 67.67 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.406 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 30' ' ' SER . 93.5 mt -66.94 -57.43 10.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.408 HD22 HG23 ' B' ' 2' ' ' ILE . 91.5 mt -58.79 -40.05 82.89 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 121.525 0.679 . . . . 0.0 109.413 178.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 3.8 m-70 -61.86 -49.13 77.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.23 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 37.1 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.796 179.801 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.612 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 55.6 t -53.14 -47.54 55.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.766 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 30.6 t80 -63.81 -32.36 73.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.7 m -66.49 -58.3 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.942 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' OE1' HG23 ' A' ' 34' ' ' ILE . 56.0 mt-10 -57.1 -45.21 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.337 -179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.581 HG23 HG21 ' A' ' 34' ' ' ILE . 97.5 t -64.57 -42.78 96.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.628 0.251 . . . . 0.0 110.634 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.86 95.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.911 0.386 . . . . 0.0 110.3 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -58.69 -39.62 81.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.131 179.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.714 HD11 ' HB3' ' A' ' 30' ' ' SER . 3.5 mt -67.45 -59.9 3.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.66 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.448 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 4.6 m-30 -70.92 35.2 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.646 -1.161 . . . . 0.0 112.187 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 65' ' ' LEU . 38.5 ttm180 -63.1 119.86 10.34 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.08 -39.77 3.05 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.999 -179.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -83.94 53.05 2.45 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.958 0.408 . . . . 0.0 110.396 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -60.71 -7.11 2.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.019 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.657 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.7 p30 -64.08 -48.94 74.23 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.71 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 78.6 mt -72.3 -44.6 62.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.615 0.722 . . . . 0.0 109.46 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tp -52.45 -36.73 55.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.441 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 45.5 t -55.83 -44.3 77.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.582 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -66.57 -42.09 87.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.612 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 19.9 t80 -58.07 -44.95 87.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.68 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.898 -179.864 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 2' ' ' ILE . . . . . 0.408 HG23 HD22 ' A' ' 35' ' ' LEU . 43.3 mm . . . . . 0 C--O 1.226 -0.146 0 CA-C-O 120.527 0.203 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -64.45 -46.01 84.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.175 0.512 . . . . 0.0 109.824 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.9 mtm -72.41 -41.89 65.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.975 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.481 HD11 ' HD2' ' A' ' 13' ' ' TYR . 21.8 tp -64.23 -48.24 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.96 -45.33 93.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.088 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -63.99 -33.28 75.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.306 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.59 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.18 -44.03 83.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.578 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -46.5 75.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 34.5 t70 -60.08 -35.95 76.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.375 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 11' ' ' TYR . . . . . 0.442 ' HD2' HD12 ' A' ' 11' ' ' ILE . 61.9 t80 -65.15 -47.54 76.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.136 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.37 23.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.637 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 11' ' ' TYR . 4.2 tm-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.547 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t -59.4 -37.99 79.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.918 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -167.6 46.66 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t -54.1 160.43 1.55 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.509 0.671 . . . . 0.0 111.761 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.549 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 75.2 t -54.74 -33.97 29.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.903 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 51.5 mt-10 -58.47 -38.17 77.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.993 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.478 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.2 t80 -59.59 -58.49 8.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.408 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -64.7 -28.34 69.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.457 0.646 . . . . 0.0 109.342 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.549 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.4 t-20 -59.7 -42.36 92.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.549 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.59 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.49 -45.49 62.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.817 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.527 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.2 mm -54.65 -43.31 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.3 m -58.45 -36.37 73.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.872 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.5 t80 -63.72 -53.73 46.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.935 0.398 . . . . 0.0 110.684 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.7 t -61.36 -42.49 93.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.351 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -58.46 -57.46 12.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -52.99 -40.03 63.5 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.504 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.9 mt -61.9 -40.96 89.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -65.23 -55.33 19.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.273 0.558 . . . . 0.0 110.689 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.549 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -60.41 -30.88 69.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.296 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -65.95 -56.38 11.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.205 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.515 ' CD2' HG13 ' A' ' 27' ' ' ILE . 54.2 m-85 -93.29 40.16 1.06 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.14 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 19' ' ' THR . 57.5 mt -55.35 -35.03 64.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.874 0.369 . . . . 0.0 110.63 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -75.43 -39.12 59.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.735 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.56 78.53 0.45 Allowed Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.244 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -60.25 -34.72 93.64 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.712 2.275 . . . . 0.0 112.388 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -51.01 -30.41 15.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.603 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.5 mm -63.94 -45.75 96.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.03 0.443 . . . . 0.0 110.817 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.513 ' CE2' HD11 ' A' ' 32' ' ' LEU . 43.5 t80 -54.91 -48.0 73.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.868 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.597 ' NH2' HD12 ' A' ' 32' ' ' LEU . 12.5 mmp_? -54.97 -51.86 64.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.47 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.3 t -54.53 -56.76 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.996 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.78 -50.72 32.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.043 0.449 . . . . 0.0 111.163 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.597 HD12 ' NH2' ' A' ' 29' ' ' ARG . 61.5 mt -60.99 -40.06 92.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.622 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.1 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.737 HG22 HG13 ' A' ' 58' ' ' VAL . 83.1 mt -63.87 -60.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.62 HD22 HG23 ' B' ' 2' ' ' ILE . 96.6 mt -55.89 -38.47 70.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.378 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -62.79 -46.62 87.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.869 179.136 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.547 HG22 ' SD ' ' A' ' 53' ' ' MET . 94.7 m -50.98 -40.14 57.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.106 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.533 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 59.6 t80 -51.06 -50.61 58.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.447 178.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.46 HE21 ' CD2' ' B' ' 6' ' ' LEU . 51.9 mm-40 -58.27 -42.08 85.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.26 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -57.29 -49.95 74.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.088 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.533 ' HB2' ' HB3' ' A' ' 53' ' ' MET . 67.5 mm-40 -80.36 47.71 0.95 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.251 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -142.31 -47.08 0.34 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.794 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 44' ' ' HIS . 91.0 mt -70.67 -145.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.767 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 31.4 m170 70.86 45.57 0.54 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.277 0.561 . . . . 0.0 109.923 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.5 p 51.37 -133.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.274 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -53.37 134.94 39.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.008 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -77.2 58.36 3.63 Favored Glycine 0 CA--C 1.517 0.19 0 CA-C-N 115.87 -0.604 . . . . 0.0 113.303 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 81.3 mtm180 -55.81 138.29 71.0 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.562 0.22 . . . . 0.0 110.76 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.92 131.66 33.81 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.601 2.201 . . . . 0.0 112.493 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -179.13 51.63 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.289 0.566 . . . . 0.0 110.269 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 53.61 60.05 3.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.197 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.84 -134.53 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.233 -0.894 . . . . 0.0 113.057 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.547 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.1 ttt -170.79 160.93 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.773 0.321 . . . . 0.0 111.216 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.48 ' OG ' ' HG2' ' A' ' 56' ' ' GLU . 78.7 p -158.75 -149.89 0.23 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -69.54 -36.0 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.45 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.48 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.1 pt-20 -53.8 -47.7 70.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.923 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 14.4 tp10 -65.78 -48.83 70.47 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.714 0.292 . . . . 0.0 111.287 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.737 HG13 HG22 ' A' ' 34' ' ' ILE . 48.6 t -52.9 -42.3 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.721 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.2 t80 -60.05 -38.86 84.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.642 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -70.94 -50.61 32.71 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.638 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' HG23 ' A' ' 34' ' ' ILE . 92.5 mt-10 -57.3 -47.27 81.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.239 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.483 HG23 HG21 ' A' ' 34' ' ' ILE . 98.3 t -64.55 -41.38 92.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 1.005 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.77 -40.47 92.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.164 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -60.61 -40.72 92.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.468 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mt -63.94 -63.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.333 0.587 . . . . 0.0 110.769 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.496 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.3 m-30 -75.47 42.23 0.21 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.735 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 67' ' ' ARG . 12.0 tpt180 -59.13 130.97 49.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.648 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.22 -41.93 2.08 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.188 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -82.23 53.94 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.981 0.42 . . . . 0.0 110.535 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.706 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.4 mt-10 -63.46 1.7 0.51 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.179 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -61.47 -50.05 74.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.136 0.493 . . . . 0.0 109.874 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.28 -32.69 66.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.892 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 1.005 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.17 -38.94 68.97 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.259 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.566 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 33.4 t -56.86 -40.97 77.1 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.571 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -64.2 -50.26 68.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.463 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.606 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 14.7 t80 -58.08 -42.36 85.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.23 -34.76 81.52 Favored Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.728 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 74' ' ' SER . 85.9 mt-30 -54.01 -43.48 70.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.757 0.313 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.671 ' HB3' ' HB2' ' B' ' 1' ' ' ASN . 5.7 m-85 -67.93 -47.71 67.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.517 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.429 HD21 HD11 ' B' ' 2' ' ' ILE . 44.2 mt -67.78 147.54 98.58 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.546 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -55.79 128.1 28.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.311 2.007 . . . . 0.0 112.307 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.06 132.51 48.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.99 -145.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.232 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -69.93 141.52 53.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.061 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.441 ' HD2' ' C ' ' A' ' 85' ' ' ARG . 4.1 tmm_? . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.318 -0.848 . . . . 0.0 110.5 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.671 ' HB2' ' HB3' ' A' ' 79' ' ' PHE . 20.9 p30 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.803 0.335 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.62 HG23 HD22 ' A' ' 35' ' ' LEU . 46.9 mm -63.86 -32.68 58.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.836 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -55.19 -40.91 71.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -66.22 -46.82 75.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.862 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.59 HD23 ' HB1' ' A' ' 10' ' ' ALA . 70.2 mt -67.41 -48.83 66.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.848 0.356 . . . . 0.0 111.181 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.46 ' CD2' HE21 ' A' ' 39' ' ' GLN . 67.7 tp -57.11 -45.03 83.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.591 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.74 -37.38 76.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.838 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.527 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -53.04 -41.78 65.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.557 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.58 -45.39 73.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.29 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -62.58 -39.41 93.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.722 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -57.53 -55.01 40.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.411 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.62 -45.27 91.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.92 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -161.93 -52.2 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.687 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -73.76 76.74 1.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.858 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 t -50.96 148.74 3.99 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.555 0.693 . . . . 0.0 111.852 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.597 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 74.9 t -55.44 -39.11 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.057 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 92.4 mt-10 -59.8 -36.8 77.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -61.65 -59.53 5.05 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 -62.98 -29.34 70.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.446 0.641 . . . . 0.0 109.314 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.597 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.0 t-20 -57.18 -43.69 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.543 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.79 -43.94 71.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.525 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.638 HD13 ' CB ' ' B' ' 8' ' ' ALA . 38.1 mm -50.58 -45.42 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.964 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.571 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 48.3 t -57.74 -38.9 76.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.597 -178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.693 ' HD2' HD11 ' B' ' 5' ' ' LEU . 29.9 t80 -61.96 -52.0 65.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' B' ' 8' ' ' ALA . 26.4 t -63.05 -36.08 74.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.599 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -66.32 -47.18 74.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.531 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 12' ' ' SER . 24.9 mtpp -61.54 -41.14 96.9 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 13' ' ' TYR . 96.7 mt -59.67 -37.53 71.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.841 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -67.27 -49.85 62.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.956 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.9 t -71.28 -28.16 63.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.91 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -65.33 -59.87 3.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.955 0.407 . . . . 0.0 111.253 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.558 ' CD2' HG13 ' A' ' 27' ' ' ILE . 66.9 m-85 -93.7 41.54 1.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.774 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 19' ' ' THR . 65.6 mt -54.16 -34.99 61.78 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.631 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -75.27 -37.75 60.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.428 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -106.71 78.56 0.57 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.25 -32.95 97.06 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.729 2.286 . . . . 0.0 112.327 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.24 -34.95 34.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.917 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.6 mm -64.58 -47.75 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.548 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 13.3 t80 -61.51 -59.32 5.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.602 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 22.4 mmt85 -49.79 -53.66 23.88 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.807 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.9 p -51.9 -51.54 56.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.075 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 34' ' ' ILE . 46.0 t80 -51.25 -50.06 59.95 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.076 0.465 . . . . 0.0 110.509 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 47.7 mt -57.36 -41.7 80.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.008 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 50.4 mt-10 -64.61 -30.21 71.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.531 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 30' ' ' SER . 66.6 mt -62.44 -54.55 32.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 120.968 0.413 . . . . 0.0 109.927 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' B' ' 6' ' ' LEU . 63.2 mt -61.7 -39.16 90.5 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -59.78 -42.61 93.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.938 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.405 HG22 ' SD ' ' A' ' 53' ' ' MET . 83.6 m -62.6 -39.16 92.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.214 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.496 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 42.4 t80 -54.12 -57.73 9.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.801 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.473 ' HG3' HD23 ' B' ' 6' ' ' LEU . 13.1 mm100 -61.0 -41.86 97.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 68.4 mttm -58.28 -46.7 85.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.703 0.287 . . . . 0.0 111.443 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 37' ' ' THR . 66.5 mm-40 -66.6 -47.01 74.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.468 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -60.34 -48.83 80.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.404 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.514 ' O ' ' HB2' ' A' ' 44' ' ' HIS . 95.6 mt -62.34 135.24 57.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.081 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.514 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 34.9 m170 81.41 120.96 0.05 OUTLIER 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 71.2 p -66.48 -140.68 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.575 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? 56.63 61.75 2.54 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.849 0.356 . . . . 0.0 110.939 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -159.87 141.74 7.71 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.487 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.5 ' HB2' ' HB2' ' A' ' 51' ' ' ARG . 98.6 mtt180 -52.68 137.97 42.72 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-O 120.644 0.259 . . . . 0.0 111.028 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.95 124.79 12.25 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.503 2.135 . . . . 0.0 112.237 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.7 t80 52.18 46.6 26.34 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.401 0.62 . . . . 0.0 110.591 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 36.5 mmt180 -147.99 59.29 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.847 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -158.6 -106.91 0.23 Allowed Glycine 0 CA--C 1.508 -0.352 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.862 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.405 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.3 ttt -137.93 144.34 41.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.991 0.424 . . . . 0.0 111.413 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 58' ' ' VAL . 79.1 p -161.1 -154.59 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.366 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -60.74 -33.22 72.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.703 0.287 . . . . 0.0 111.309 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.4 pt-20 -62.03 -50.75 70.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.435 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 29.7 tt0 -73.21 -44.2 60.04 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 54' ' ' SER . 98.4 t -52.97 -43.37 47.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.037 0.446 . . . . 0.0 110.219 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.6 t80 -62.59 -35.17 78.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.502 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.8 m -67.16 -56.53 9.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.065 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -56.87 -44.49 82.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.417 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 58' ' ' VAL . 98.0 t -64.09 -41.71 93.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.201 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.953 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.57 -43.59 97.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.103 0.478 . . . . 0.0 110.271 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -61.45 -40.2 93.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.617 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 27' ' ' ILE . 2.8 mt -62.87 -63.83 1.1 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.45 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.521 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.1 m-30 -75.28 42.25 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.66 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -61.5 133.46 55.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 0.0 110.226 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.47 -45.58 3.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.776 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.7 OUTLIER -84.15 49.78 1.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.806 0.336 . . . . 0.0 110.318 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.647 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.7 mt-10 -65.19 6.32 0.28 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.652 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.9 p30 -66.88 -45.51 77.84 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.652 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 60.3 mt -72.72 -34.98 67.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.747 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.953 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -51.45 -43.88 62.21 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.223 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 35.2 t -55.88 -41.04 73.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.931 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -64.35 -45.51 87.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.698 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.624 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.0 t80 -57.96 -43.8 86.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.885 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.54 -23.47 73.7 Favored Glycine 0 CA--C 1.519 0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.556 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 74' ' ' SER . 12.6 mm100 -44.53 -53.97 6.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.901 0.35 . . . . 0.0 111.69 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -76.37 -38.71 55.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.886 0.374 . . . . 0.0 110.572 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.488 HD21 HD11 ' B' ' 2' ' ' ILE . 61.4 mt -60.81 151.67 72.04 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.879 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.57 138.73 81.5 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.604 2.203 . . . . 0.0 112.276 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -57.65 -40.4 79.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.334 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.66 143.89 23.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.512 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.5 tttm -163.02 -60.56 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.001 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.028 -179.84 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 5.0 m120 . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.534 0.207 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 35' ' ' LEU . 48.5 mm -63.59 -30.84 50.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.772 0.32 . . . . 0.0 111.361 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -61.02 -48.64 80.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.876 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 23.6 ptp -73.12 -40.82 64.61 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.148 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.693 HD11 ' HD2' ' A' ' 13' ' ' TYR . 26.7 tp -60.87 -50.73 72.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.032 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.5 tp -63.18 -40.81 98.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.149 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -60.6 -34.36 74.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.991 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.638 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.53 -42.29 78.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.141 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.537 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -58.11 -43.72 87.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.05 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -61.01 -42.81 99.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.499 ' HD2' HD12 ' A' ' 11' ' ' ILE . 39.8 t80 -61.28 -55.38 32.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.176 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.6 mt -60.81 -35.21 75.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.015 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.977 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.532 0.205 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 t -58.37 -50.55 73.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 111.076 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -66.95 127.85 34.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.681 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 p -62.08 143.21 56.95 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.536 0.684 . . . . 0.0 112.462 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.04 -41.51 68.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.111 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.32 -35.15 59.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.136 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.507 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.9 t80 -65.06 -64.8 0.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.4 m-80 -59.32 -43.84 92.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.13 0.491 . . . . 0.0 110.187 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -55.04 -41.52 71.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.667 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.601 ' HB1' ' HA ' ' B' ' 5' ' ' LEU . . . -63.49 -39.77 95.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.937 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.616 HD13 ' CB ' ' B' ' 8' ' ' ALA . 39.1 mm -60.77 -44.7 97.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.501 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 t -59.43 -42.29 91.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.64 ' HD2' HD11 ' B' ' 5' ' ' LEU . 12.6 t80 -59.37 -51.78 68.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.911 0.386 . . . . 0.0 110.501 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 ' HA ' ' B' ' 9' ' ' ALA . 47.7 t -57.33 -44.12 83.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -59.2 -58.27 9.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.173 0.511 . . . . 0.0 110.882 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.563 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.7 ttmt -53.45 -38.95 64.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.715 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.556 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 71.0 mt -61.77 -40.84 88.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.068 0.461 . . . . 0.0 110.149 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HZ3' HD13 ' B' ' 12' ' ' LEU . 3.4 ttmp? -65.17 -55.41 18.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.602 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.4 t -61.22 -30.29 70.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.79 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -63.75 -57.61 9.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.236 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD2' HG13 ' A' ' 27' ' ' ILE . 53.7 m-85 -95.52 43.44 1.09 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.047 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 19' ' ' THR . 66.6 mt -55.58 -35.5 65.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 110.751 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -74.77 -37.2 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.727 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -107.17 77.51 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.517 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.072 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -59.35 -33.72 97.66 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.591 2.194 . . . . 0.0 112.329 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -50.76 -32.28 19.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.044 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.524 HG13 ' CD2' ' A' ' 21' ' ' PHE . 7.8 mm -64.39 -47.8 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.706 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.564 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.2 t80 -59.8 -49.68 76.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.119 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -55.87 -53.2 59.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -52.88 -47.41 67.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.842 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HA ' HD12 ' A' ' 34' ' ' ILE . 41.9 t80 -53.7 -48.57 69.41 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.169 0.509 . . . . 0.0 110.88 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 51.9 mt -59.71 -46.76 88.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.438 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 44.2 tt0 -58.81 -30.59 67.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 30' ' ' SER . 97.2 mt -62.24 -60.45 2.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.737 ' HB2' HD13 ' B' ' 6' ' ' LEU . 58.6 mt -59.95 -35.84 75.8 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 15.3 m-70 -61.63 -42.98 99.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.943 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.1 m -62.66 -37.17 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.167 0.508 . . . . 0.0 110.319 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.408 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 56.8 t80 -58.89 -61.39 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.47 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.598 ' HG3' HD23 ' B' ' 6' ' ' LEU . 13.8 mm100 -61.69 -45.9 92.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.375 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -56.28 -49.52 74.01 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -80.17 43.1 0.6 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.767 0.318 . . . . 0.0 111.262 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -152.23 -52.11 0.11 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.702 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.2 mt -72.57 -59.06 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.989 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -94.04 -41.11 9.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.601 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.4 m 66.71 130.27 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.993 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HD2' ' HA ' ' A' ' 46' ' ' LYS . 40.8 tptt -177.29 117.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.264 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.72 152.79 6.17 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.702 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.451 HH11 ' HG3' ' A' ' 48' ' ' ARG . 60.0 mtt85 -49.64 146.75 6.81 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.566 0.222 . . . . 0.0 110.957 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -49.0 144.52 15.5 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.969 2.446 . . . . 0.0 112.707 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -158.28 163.59 37.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.196 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -74.66 43.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.94 164.3 0.93 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.601 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.542 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 24.4 ttt -146.43 144.8 29.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.349 -0.426 . . . . 0.0 110.942 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.544 ' O ' HG23 ' A' ' 58' ' ' VAL . 78.8 p -169.31 -144.47 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.487 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -56.9 -31.04 64.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.838 0.352 . . . . 0.0 110.895 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 14.6 pt-20 -58.42 -50.28 74.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.9 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.542 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 28.2 tt0 -79.25 -44.7 21.23 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 54' ' ' SER . 65.7 t -52.83 -41.14 38.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.724 0.297 . . . . 0.0 110.848 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.47 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 21.0 t80 -61.71 -39.13 90.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.401 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 16.4 m -67.59 -50.83 56.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.882 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 57.8 mm-40 -56.88 -48.68 77.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.484 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.48 -44.99 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.81 0.338 . . . . 0.0 111.586 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.985 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.1 -44.2 97.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.506 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 1.1 p30 -62.42 -38.96 91.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.109 0.481 . . . . 0.0 110.247 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.476 HD12 HD11 ' A' ' 34' ' ' ILE . 3.0 mt -60.05 -63.1 1.42 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.191 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.5 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 9.8 m-30 -74.2 41.19 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.597 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -61.06 131.86 51.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.361 . . . . 0.0 110.531 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -45.35 3.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.562 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -86.61 53.88 2.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.035 0.445 . . . . 0.0 110.341 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 95.5 mt-10 -59.97 -5.54 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.023 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -60.85 -45.23 95.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 0.0 110.018 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 17' ' ' ILE . 91.4 mt -71.98 -36.11 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.985 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.985 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -53.41 -44.25 68.59 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.73 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.479 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 67.3 m -53.47 -41.33 66.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.815 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.93 -46.91 70.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.08 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.566 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.9 t80 -57.7 -41.76 82.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.161 0.505 . . . . 0.0 110.021 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.68 -30.07 75.71 Favored Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.76 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 74' ' ' SER . 99.0 mm-40 -50.67 -47.06 58.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.714 0.292 . . . . 0.0 110.997 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -68.33 -48.36 65.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.037 0.446 . . . . 0.0 110.563 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 76' ' ' PHE . 25.3 mt -64.58 133.16 95.61 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.416 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.46 105.97 0.39 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 121.959 1.773 . . . . 0.0 111.91 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.15 144.15 56.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -160.86 -50.44 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.713 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -72.08 -150.71 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.756 0.312 . . . . 0.0 111.167 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 48.1 ttm-85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.901 -179.912 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.936 0.398 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.706 HG23 HD22 ' A' ' 35' ' ' LEU . 44.7 mm -71.45 -36.53 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.112 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 tm0? -54.22 -41.34 68.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.498 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 64.4 mtt -70.31 -42.54 71.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.212 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.64 HD11 ' HD2' ' A' ' 13' ' ' TYR . 19.6 tp -64.42 -49.08 72.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.824 0.345 . . . . 0.0 110.968 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.737 HD13 ' HB2' ' A' ' 35' ' ' LEU . 30.8 tp -63.45 -43.25 97.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.15 -34.45 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.158 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.616 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.15 -38.97 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.502 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.94 -45.22 74.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.002 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -63.72 -39.15 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.59 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -55.83 -54.21 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.506 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.578 HD13 ' HZ3' ' A' ' 18' ' ' LYS . 95.8 mt -63.69 -45.86 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.266 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.861 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.372 0.13 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.4 p 57.76 130.23 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.65 0.594 . . . . 0.0 111.809 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -70.86 -133.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.83 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 p -55.93 151.25 11.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.43 0.633 . . . . 0.0 112.179 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 72.8 t -55.38 -37.01 42.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.269 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 45.7 mt-10 -57.16 -36.41 70.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.159 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.527 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.6 t80 -58.95 -57.72 11.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.716 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -32.61 74.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.552 0.691 . . . . 0.0 109.33 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.8 t-20 -56.02 -42.33 76.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.27 -42.14 65.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.011 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HB1' ' B' ' 8' ' ' ALA . 41.8 mm -54.02 -42.99 57.07 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.817 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 m -54.53 -38.53 66.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.132 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 39.4 t80 -66.86 -57.46 6.96 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.931 0.396 . . . . 0.0 111.019 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' B' ' 9' ' ' ALA . 39.5 t -57.19 -43.89 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.269 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.54 -52.39 63.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.993 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -53.36 -40.08 64.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.0 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.708 HG12 HD13 ' A' ' 72' ' ' LEU . 91.9 mt -62.31 -38.19 80.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.19 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -68.97 -49.23 59.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.075 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.6 t -69.82 -27.97 65.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.654 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.431 ' HG2' HH11 ' A' ' 20' ' ' ARG . 10.5 tpt180 -67.73 -58.45 4.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.571 ' HZ ' ' HG3' ' A' ' 69' ' ' GLN . 53.1 m-85 -90.94 38.89 0.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 72.7 mt -54.24 -34.87 61.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.044 0.449 . . . . 0.0 110.342 179.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.23 -37.22 61.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.42 78.69 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.121 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -59.04 -35.15 98.89 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.84 2.36 . . . . 0.0 112.809 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -50.84 -33.09 22.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.378 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.4 mm -64.54 -48.35 85.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.117 0.484 . . . . 0.0 111.036 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.543 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.0 t80 -59.27 -49.89 76.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.409 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -58.3 -56.17 25.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.041 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.638 ' HB2' HD11 ' A' ' 65' ' ' LEU . 60.7 m -53.44 -49.76 66.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.528 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.5 t80 -52.03 -49.68 62.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.986 0.422 . . . . 0.0 111.068 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 86.6 mt -58.66 -41.73 86.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.475 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.61 -30.25 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.121 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 30' ' ' SER . 78.1 mt -62.41 -55.1 26.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.832 HD22 HG23 ' B' ' 2' ' ' ILE . 54.2 mt -62.83 -38.62 91.51 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.449 0.643 . . . . 0.0 109.534 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.541 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 1.8 m-70 -60.82 -47.23 87.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.221 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.4 m -61.18 -37.02 81.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.615 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 30.2 t80 -54.0 -60.21 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.162 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -60.47 -39.52 87.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.134 -179.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 28.6 mtpp -52.24 -54.45 30.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.619 0.247 . . . . 0.0 111.548 -179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' OE2' ' HA3' ' A' ' 52' ' ' GLY . 87.4 tt0 -72.99 -32.93 65.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.876 0.369 . . . . 0.0 110.742 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -56.86 -40.53 76.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.517 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 80.7 mt -63.84 -147.72 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.803 0.335 . . . . 0.0 111.419 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -178.3 142.11 0.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.6 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 p -127.82 107.78 10.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER 47.72 45.38 18.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.159 179.803 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.55 148.31 8.03 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.885 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -52.27 143.41 25.92 Favored Pre-proline 0 C--N 1.332 -0.179 0 CA-C-O 120.625 0.25 . . . . 0.0 111.111 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.14 -160.89 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.68 2.254 . . . . 0.0 112.625 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -173.21 134.02 0.53 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.514 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -81.31 36.9 0.43 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.318 0.58 . . . . 0.0 110.898 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA3' ' OE2' ' A' ' 41' ' ' GLU . . . -62.24 -35.27 91.33 Favored Glycine 0 CA--C 1.509 -0.332 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.613 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.552 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 26.7 ttt -144.94 143.28 30.46 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.859 0.362 . . . . 0.0 111.026 -179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.615 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 10.3 t -162.05 -145.64 0.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.444 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.406 ' HG2' ' HD2' ' A' ' 81' ' ' PRO . 44.0 mp0 -61.0 -34.98 75.66 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.814 0.34 . . . . 0.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.439 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 16.0 pt-20 -56.27 -49.53 73.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.053 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.552 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 75.9 tt0 -74.47 -46.53 39.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 54' ' ' SER . 59.6 t -53.55 -45.79 59.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.822 0.344 . . . . 0.0 110.832 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.581 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.4 t80 -60.23 -34.74 74.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.278 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.4 m -66.93 -58.81 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.048 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -56.72 -44.32 81.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.396 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.505 HG23 HG21 ' A' ' 34' ' ' ILE . 90.1 t -64.05 -42.17 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.474 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.37 -40.54 94.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.087 0.47 . . . . 0.0 110.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -61.29 -42.66 99.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.698 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.5 mt -67.13 -62.7 1.3 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.316 0.579 . . . . 0.0 110.952 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 3.3 m-30 -73.11 37.47 0.08 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.634 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' A' ' 69' ' ' GLN . 41.8 ttm180 -58.48 130.84 48.68 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.36 -31.83 2.1 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.764 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.571 ' HG3' ' HZ ' ' A' ' 21' ' ' PHE . 6.4 mm-40 -78.04 48.76 0.75 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.911 0.386 . . . . 0.0 110.492 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 4.9 mm-40 -56.08 -14.49 2.67 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.27 -49.83 75.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.639 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.708 HD13 HG12 ' A' ' 17' ' ' ILE . 88.0 mt -70.0 -34.04 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.234 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 1.3 mm? -58.51 -37.38 75.48 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 74.8 m -54.71 -39.26 68.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.322 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.51 -45.27 22.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.292 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.8 t80 -57.23 -43.78 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.134 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -39.59 96.69 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.989 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 74' ' ' SER . 85.8 mt-30 -53.62 -46.77 70.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.774 0.321 . . . . 0.0 111.14 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.706 ' HB3' ' HB2' ' B' ' 1' ' ' ASN . 2.4 m-85 -65.76 -42.73 90.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.632 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.542 HD23 HD21 ' B' ' 1' ' ' ASN . 83.8 mt -62.85 134.78 95.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.747 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.406 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 45.3 Cg_endo -69.09 114.6 3.65 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.251 1.967 . . . . 0.0 112.505 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 178.79 -55.16 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.841 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.57 133.36 46.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.26 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -175.37 46.39 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.021 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.965 179.662 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 79' ' ' PHE . 15.6 p-10 . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.782 0.325 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.832 HG23 HD22 ' A' ' 35' ' ' LEU . 45.9 mm -62.86 -40.12 87.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.178 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.75 -40.97 69.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.753 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 50.8 ttm -65.4 -45.38 84.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.498 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HB1' ' A' ' 10' ' ' ALA . 61.5 mt -65.66 -50.22 65.76 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.643 HD13 ' HB2' ' A' ' 35' ' ' LEU . 38.8 tp -58.02 -41.02 82.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.084 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -66.27 -37.54 85.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.287 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.747 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -59.16 -42.71 91.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.266 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.476 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.83 -46.84 81.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.119 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' B' ' 13' ' ' GLU . 8.2 t70 -57.47 -38.58 74.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.268 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' B' ' 8' ' ' ALA . 57.1 t80 -60.47 -50.66 72.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.436 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.437 HD21 ' CG2' ' A' ' 11' ' ' ILE . 86.2 mt -63.09 -49.81 73.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.804 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' B' ' 10' ' ' ASP . 16.4 pt-20 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.867 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . 0.419 ' OE1' ' N ' ' A' ' 1' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.703 0.287 . . . . 0.0 111.046 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -177.94 51.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.925 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -161.56 133.85 5.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.873 0.368 . . . . 0.0 111.273 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -65.35 142.49 58.21 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.184 0.516 . . . . 0.0 111.473 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.441 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 96.6 t -62.24 -41.37 91.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.404 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.2 mt-10 -56.83 -37.26 70.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.606 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.587 ' O ' HG12 ' A' ' 11' ' ' ILE . 16.4 t80 -59.54 -57.74 11.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.626 0.251 . . . . 0.0 110.716 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -32.21 73.74 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.471 0.653 . . . . 0.0 109.267 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.459 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.4 t-20 -55.43 -44.3 76.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.708 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.42 -42.69 64.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.827 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 7' ' ' PHE . 48.8 mm -51.63 -54.26 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.112 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.6 p -51.03 -33.62 26.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.781 ' HD2' HD11 ' B' ' 5' ' ' LEU . 30.9 t80 -63.2 -48.72 77.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.502 HG21 ' HB3' ' B' ' 8' ' ' ALA . 32.3 t -68.3 -40.24 82.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.742 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -62.24 -42.72 99.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.908 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.2 ttmt -66.24 -39.34 89.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.36 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 13' ' ' TYR . 85.7 mt -60.02 -40.82 84.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.175 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -64.47 -56.77 11.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.6 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.69 -29.67 70.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.008 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -68.09 -59.6 3.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.929 0.395 . . . . 0.0 111.283 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.549 ' CD2' HG13 ' A' ' 27' ' ' ILE . 60.3 m-85 -91.75 39.17 1.0 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.09 -37.24 53.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.964 0.411 . . . . 0.0 110.577 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.92 -37.46 58.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -104.16 78.61 0.34 Allowed Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.269 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -59.35 -35.42 96.69 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.87 2.38 . . . . 0.0 112.602 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -51.07 -33.12 24.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.048 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -64.44 -51.28 70.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.804 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 49.0 t80 -58.03 -47.73 82.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.629 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG2' HH11 ' A' ' 29' ' ' ARG . 49.7 mmt-85 -55.97 -52.22 64.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.319 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.629 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.0 m -53.69 -52.82 58.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.522 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -50.16 -51.67 41.66 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.088 0.47 . . . . 0.0 110.97 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 74.4 mt -58.17 -44.55 88.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.41 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 17.6 tp10 -62.13 -29.18 70.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.691 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.643 HG22 HG13 ' A' ' 58' ' ' VAL . 72.2 mt -64.33 -56.75 14.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.021 0.438 . . . . 0.0 109.935 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.79 HD22 HG23 ' B' ' 2' ' ' ILE . 56.9 mt -62.71 -40.08 96.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.458 0.647 . . . . 0.0 109.322 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.508 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 12.1 m-70 -59.14 -47.5 85.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.546 HG22 ' SD ' ' A' ' 53' ' ' MET . 76.5 m -59.86 -38.4 82.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.738 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.443 ' HB2' ' HE1' ' A' ' 53' ' ' MET . 39.5 t80 -58.28 -53.81 54.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.669 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.457 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.2 mm100 -66.09 -43.64 86.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.967 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 99.1 mttt -56.79 -46.78 81.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.714 0.292 . . . . 0.0 111.307 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 41' ' ' GLU . 37.4 tt0 -80.05 42.33 0.56 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.181 0.515 . . . . 0.0 110.818 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -156.47 -41.84 0.07 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 95.5 mt -57.01 -41.79 79.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.243 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -168.49 130.66 1.37 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 111.147 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 81.9 p -98.66 136.98 37.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.416 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.712 ' H ' ' HZ2' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -66.26 -32.8 74.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.582 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -156.05 -140.67 3.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.381 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -65.56 134.59 95.51 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.678 0.275 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -75.6 148.76 33.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.739 2.293 . . . . 0.0 112.481 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -162.74 133.08 4.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.584 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.432 HH11 ' HG3' ' A' ' 51' ' ' ARG . 0.0 OUTLIER 57.03 56.67 5.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.384 0.611 . . . . 0.0 110.062 -179.706 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.3 137.82 44.3 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.23 -0.896 . . . . 0.0 113.253 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.546 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.2 ttt -95.86 146.73 24.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.727 -0.736 . . . . 0.0 110.992 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.628 ' O ' HG23 ' A' ' 58' ' ' VAL . 80.9 p -154.5 -159.35 0.95 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.059 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -62.56 -35.11 78.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.533 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.538 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 11.9 pt-20 -58.57 -47.56 83.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.506 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 60' ' ' THR . 24.0 tt0 -71.09 -44.5 65.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.523 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.643 HG13 HG22 ' A' ' 34' ' ' ILE . 61.0 t -53.66 -43.46 54.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.872 0.368 . . . . 0.0 110.358 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 31.3 t80 -61.74 -33.61 74.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.197 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 45.3 m -68.0 -57.2 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.138 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.32 -43.06 83.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.513 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 58' ' ' VAL . 89.4 t -64.16 -41.35 92.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 110.119 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.784 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.63 -40.92 93.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.28 -37.55 87.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.936 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.546 HD22 HG23 ' A' ' 27' ' ' ILE . 5.6 mt -65.63 -65.45 0.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.494 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.708 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.3 m-30 -76.03 44.9 0.33 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.562 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -62.69 137.23 58.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.66 -43.98 2.87 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.295 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 71' ' ' ASP . 16.9 pt20 -96.16 56.45 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.757 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 57.8 mp0 -65.81 8.36 0.19 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.153 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.3 t70 -61.49 -44.64 96.72 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.25 -38.59 75.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.596 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.784 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -55.19 -39.77 69.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.946 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.7 t -56.13 -40.24 73.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.525 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -68.39 -44.45 75.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.793 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.605 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.0 t80 -56.97 -42.0 79.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.803 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.53 -40.63 96.53 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.763 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -53.35 -42.41 66.78 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.73 0.3 . . . . 0.0 111.042 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.34 -44.9 93.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.99 0.424 . . . . 0.0 110.497 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.646 HD21 HD11 ' B' ' 2' ' ' ILE . 67.1 mt -63.89 139.24 97.61 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.708 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.41 137.82 80.51 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.621 2.214 . . . . 0.0 112.146 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -78.08 40.19 0.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.464 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.77 -170.45 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.71 0.29 . . . . 0.0 111.127 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.489 ' HD3' ' C ' ' A' ' 84' ' ' LYS . 8.0 tmtm? -177.27 123.14 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.213 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.414 ' HG2' HH11 ' A' ' 85' ' ' ARG . 3.5 ptp85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.072 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.88 0.372 . . . . 0.0 111.266 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.79 HG23 HD22 ' A' ' 35' ' ' LEU . 47.4 mm -56.51 -36.0 46.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.814 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -57.51 -45.37 85.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.571 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 77.4 mtp -71.89 -43.61 65.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.722 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.781 HD11 ' HD2' ' A' ' 13' ' ' TYR . 18.9 tp -61.05 -51.33 69.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.825 0.345 . . . . 0.0 110.795 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.709 HD13 ' HB2' ' A' ' 35' ' ' LEU . 29.8 tp -60.76 -38.42 85.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.098 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.85 -35.62 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.577 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.25 -39.61 66.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.317 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.66 -44.48 73.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -63.6 -39.29 94.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.928 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.429 ' HD2' HD12 ' A' ' 11' ' ' ILE . 43.1 t80 -57.85 -54.5 46.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.52 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -63.05 -47.38 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.114 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.871 179.96 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.807 0.337 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t -171.08 133.43 0.88 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.808 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.2 131.86 50.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.823 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.3 p -63.84 150.77 44.05 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 112.049 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 76.7 t -55.26 -37.26 43.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.122 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.3 mt-10 -59.67 -35.27 74.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.364 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.453 ' O ' HG12 ' A' ' 11' ' ' ILE . 15.4 t80 -59.84 -56.76 17.77 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.514 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -33.81 76.79 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.469 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.5 t-20 -55.62 -41.42 73.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.809 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.706 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.28 -39.11 71.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.778 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.602 HD13 ' HB1' ' B' ' 8' ' ' ALA . 37.7 mm -52.61 -42.59 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.271 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.1 t -54.96 -38.03 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.107 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.608 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.6 t80 -67.48 -56.91 7.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.444 HG21 ' HB3' ' B' ' 8' ' ' ALA . 44.6 t -57.33 -40.43 74.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.217 0.532 . . . . 0.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.02 -54.97 21.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.053 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HA ' HG22 ' A' ' 19' ' ' THR . 63.4 tttm -53.71 -39.72 65.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.06 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.595 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 87.2 mt -62.73 -37.57 79.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.822 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -66.12 -47.93 72.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.916 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -70.74 -28.86 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.176 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.563 ' HG2' HD11 ' A' ' 72' ' ' LEU . 26.4 tpt180 -65.22 -56.7 11.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.49 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.3 m-85 -91.89 40.35 1.04 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.604 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 19' ' ' THR . 35.7 mt -56.61 -31.88 64.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.934 0.397 . . . . 0.0 110.649 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -74.71 -38.05 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.315 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.43 ' HB3' HG12 ' A' ' 27' ' ' ILE . 90.9 m-70 -106.66 78.92 0.59 Allowed Pre-proline 0 N--CA 1.447 -0.581 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.43 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 20.8 Cg_endo -58.98 -35.02 99.34 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.765 2.31 . . . . 0.0 112.604 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -53.01 -29.66 30.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.186 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.689 HG23 HD22 ' A' ' 65' ' ' LEU . 15.5 mm -64.25 -49.31 81.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.37 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.62 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.4 t80 -55.59 -50.83 69.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.847 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.43 -51.03 71.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.477 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.566 ' O ' HG13 ' A' ' 34' ' ' ILE . 48.3 t -52.31 -53.65 41.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.352 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -50.47 -50.36 52.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.254 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 29.4 mt -59.92 -40.55 89.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.4 mm-40 -64.73 -32.7 74.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.193 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 30' ' ' SER . 75.9 mt -61.47 -54.17 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 120.867 0.365 . . . . 0.0 110.367 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.673 HD22 HG23 ' B' ' 2' ' ' ILE . 77.5 mt -61.92 -42.3 98.93 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.475 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER -56.56 -46.16 80.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.918 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.583 HG22 ' SD ' ' A' ' 53' ' ' MET . 95.8 m -48.45 -34.76 11.59 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.971 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.495 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 68.1 t80 -55.83 -52.9 62.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.297 0.57 . . . . 0.0 110.813 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.546 ' NE2' HD23 ' B' ' 6' ' ' LEU . 59.4 mt-30 -70.46 -34.46 72.45 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.692 -179.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 75.2 mmtt -52.72 -47.99 66.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.807 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.83 -43.75 92.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.685 0.278 . . . . 0.0 111.578 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -65.71 -33.44 75.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.353 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.34 45.19 0.45 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.025 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.2 m170 -121.91 5.55 9.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.642 0.258 . . . . 0.0 110.828 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.738 HG22 ' HG2' ' A' ' 46' ' ' LYS . 22.6 m 62.86 140.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.352 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.738 ' HG2' HG22 ' A' ' 45' ' ' THR . 46.4 mmtm 62.75 140.69 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.331 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.47 125.66 1.28 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.955 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 48' ' ' ARG . 69.6 mtt-85 -81.81 146.73 56.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.535 0.207 . . . . 0.0 110.938 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.481 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 9.5 Cg_endo -52.22 144.33 39.14 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.82 2.347 . . . . 0.0 111.655 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.5 ' O ' ' HB3' ' A' ' 51' ' ' ARG . 36.2 t80 70.09 155.04 0.13 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.704 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 50' ' ' PHE . 40.0 ttm-85 70.02 104.0 0.06 Allowed 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.303 0.573 . . . . 0.0 110.605 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.51 132.64 1.45 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.789 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.595 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 24.2 ttt -57.29 148.05 23.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.029 -0.586 . . . . 0.0 111.816 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.503 ' O ' HG23 ' A' ' 58' ' ' VAL . 79.5 p -166.56 -146.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.533 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.9 mp0 -58.31 -29.93 66.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.318 . . . . 0.0 111.023 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 14.5 pt-20 -58.42 -50.73 72.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.014 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.595 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 29.0 tt0 -82.12 -44.69 16.17 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.531 HG11 HD12 ' B' ' 2' ' ' ILE . 88.2 t -53.04 -44.9 52.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.171 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 18.0 t80 -61.92 -34.21 75.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.907 0.384 . . . . 0.0 110.688 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.9 m -66.06 -56.68 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.14 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HB2' HG23 ' A' ' 34' ' ' ILE . 58.7 mm-40 -58.6 -44.93 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.629 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.531 HG23 HG21 ' A' ' 34' ' ' ILE . 99.6 t -64.05 -42.47 95.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.736 0.303 . . . . 0.0 110.406 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.55 97.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.226 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -58.63 -41.72 86.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.039 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.689 HD22 HG23 ' A' ' 27' ' ' ILE . 4.8 mt -63.37 -60.18 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.555 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.567 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 5.3 m-30 -73.52 39.17 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.957 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.411 ' HG2' HH11 ' A' ' 67' ' ' ARG . 52.2 ttp85 -61.63 128.92 38.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.789 0.328 . . . . 0.0 110.42 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.19 -41.78 2.67 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.283 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -83.96 57.87 4.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.93 0.395 . . . . 0.0 110.998 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -63.65 -3.3 2.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.51 -54.98 36.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.925 0.393 . . . . 0.0 110.686 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' HG2' ' A' ' 20' ' ' ARG . 49.9 mt -68.62 -42.78 77.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.509 0.671 . . . . 0.0 109.933 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 tp -51.97 -38.14 55.57 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.206 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 39.3 t -55.73 -42.83 75.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 46.4 mt-10 -63.98 -45.29 89.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.292 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.608 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 16.3 t80 -57.54 -44.37 85.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.524 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.4 -28.94 70.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.785 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 74' ' ' SER . 97.9 mm-40 -49.93 -46.56 52.21 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.731 0.301 . . . . 0.0 111.27 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -71.33 -43.63 66.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 59' ' ' PHE . 50.8 mt -63.28 142.04 97.8 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.169 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.28 -162.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.462 2.108 . . . . 0.0 112.179 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 60.37 56.63 3.12 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 121.02 0.438 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.82 -135.2 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.586 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -54.35 -36.37 63.74 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 120.65 0.262 . . . . 0.0 111.207 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.746 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.464 ' O ' ' HB ' ' B' ' 2' ' ' ILE . 38.1 p-10 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.828 0.347 . . . . 0.0 111.587 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.673 HG23 HD22 ' A' ' 35' ' ' LEU . 45.5 mm 73.28 -45.4 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.516 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -65.58 -33.91 77.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.073 0.464 . . . . 0.0 109.779 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.3 ttm -62.62 -49.01 76.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.634 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.706 HD23 ' HB1' ' A' ' 10' ' ' ALA . 79.3 mt -68.9 -46.05 69.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.48 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.546 HD23 ' NE2' ' A' ' 39' ' ' GLN . 45.5 tp -56.22 -39.88 73.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.07 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.62 -39.73 77.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.237 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.602 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -55.71 -39.47 71.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.112 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.62 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.24 -46.49 79.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.369 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -60.48 -39.2 86.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.669 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.83 -54.82 42.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.422 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.99 -47.08 78.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.116 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.971 -179.77 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.818 0.342 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 t -60.89 -45.46 94.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.777 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 4' ' ' SER . 48.1 t0 -172.12 -137.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.847 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.455 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 25.9 t -74.94 152.26 38.82 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.22 0.533 . . . . 0.0 110.908 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.588 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 83.7 t -61.0 -34.71 60.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.594 178.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.542 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 92.2 mt-10 -61.25 -39.44 90.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.015 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.501 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.2 t80 -63.33 -53.03 59.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -62.68 -32.17 73.19 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.0 t-20 -59.38 -41.28 88.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.543 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.599 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.07 -40.84 68.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.438 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.76 HD13 ' HB1' ' B' ' 8' ' ' ALA . 43.5 mm -54.27 -42.04 55.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 CA-C-O 120.964 0.411 . . . . 0.0 110.299 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.1 m -56.75 -38.17 72.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.594 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 15.5 t80 -68.43 -55.31 12.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.948 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.9 -44.24 90.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.126 0.489 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -60.18 -55.39 34.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.813 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.534 ' HA ' HG22 ' A' ' 19' ' ' THR . 65.6 tttm -56.42 -40.94 75.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.883 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.3 mt -60.49 -47.77 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.904 0.383 . . . . 0.0 110.64 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 38.7 ttpt -62.85 -56.68 15.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.751 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.0 t -57.29 -29.64 64.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.179 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -70.01 -55.65 9.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.768 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.489 ' CD2' HG13 ' A' ' 27' ' ' ILE . 57.2 m-85 -91.19 38.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.904 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 67.5 mt -52.8 -34.47 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.913 0.387 . . . . 0.0 110.675 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.31 -38.99 60.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -106.27 78.25 0.5 Allowed Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.234 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.98 -34.81 94.8 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.671 2.247 . . . . 0.0 112.458 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.0 -31.26 17.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.022 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.8 mm -64.33 -47.57 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 18' ' ' LYS . 62.0 t80 -58.51 -45.77 88.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.2 mmt-85 -60.01 -56.51 20.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.611 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.579 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -51.08 -49.14 61.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.988 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.8 t80 -51.23 -50.37 59.27 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.703 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.1 mt -60.22 -39.75 87.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.681 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.51 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.227 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.744 HG22 HG13 ' A' ' 58' ' ' VAL . 85.3 mt -61.47 -56.85 15.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.119 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.773 HD22 HG23 ' B' ' 2' ' ' ILE . 65.1 mt -60.7 -38.08 83.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.233 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.458 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 1.5 m-70 -62.26 -38.39 89.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.225 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 93.3 m -64.24 -45.57 87.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.079 0.466 . . . . 0.0 110.648 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.506 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 33.9 t80 -63.81 -46.81 83.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.936 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.3 tp60 -67.42 -47.07 71.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.224 -178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 36' ' ' HIS . 16.3 ttpp -52.87 -44.16 66.64 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.827 0.346 . . . . 0.0 111.032 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -42.02 94.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.417 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.566 ' O ' HG23 ' A' ' 45' ' ' THR . 66.2 tt0 -58.36 -28.65 65.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.871 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.53 -37.39 83.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.397 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -86.81 -30.55 21.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.716 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.566 HG23 ' O ' ' A' ' 42' ' ' GLN . 50.9 p 52.86 45.0 29.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.577 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -149.38 43.35 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.044 0.449 . . . . 0.0 110.713 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.4 141.06 33.19 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.412 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.41 HH11 ' HG2' ' A' ' 48' ' ' ARG . 50.0 mtp85 -50.83 143.01 15.74 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.409 -0.396 . . . . 0.0 111.14 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -60.45 134.28 54.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.721 2.281 . . . . 0.0 112.263 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.8 t80 65.82 144.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.784 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 52.54 33.99 14.58 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.61 -122.08 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.061 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.506 ' HE3' ' HB2' ' A' ' 38' ' ' TYR . 18.0 tpt -157.17 122.37 4.57 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.885 0.374 . . . . 0.0 110.768 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.58 ' O ' HG23 ' A' ' 58' ' ' VAL . 72.7 m -156.69 -150.38 0.28 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.608 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -69.62 -32.94 71.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.067 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -57.08 -47.63 80.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.786 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' HG2' ' SD ' ' A' ' 53' ' ' MET . 4.5 tp10 -68.98 -51.75 36.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.685 0.279 . . . . 0.0 111.275 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.744 HG13 HG22 ' A' ' 34' ' ' ILE . 43.2 t -53.14 -44.05 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.216 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.588 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 35.3 t80 -60.15 -37.09 79.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.1 m -73.29 -48.06 37.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.82 -46.6 81.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.705 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 58' ' ' VAL . 74.4 t -64.69 -42.35 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.024 179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.29 -41.05 88.05 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 109.959 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -61.36 -40.09 93.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.532 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 6.3 mt -67.27 -63.94 0.96 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.789 ' HB2' HD23 ' A' ' 73' ' ' LEU . 4.5 m-30 -74.85 42.76 0.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.793 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -62.16 137.92 58.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.01 -45.01 2.69 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.016 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.43 ' H ' ' HG2' ' A' ' 69' ' ' GLN . 4.8 pt20 -95.56 51.83 1.32 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.143 0.496 . . . . 0.0 110.277 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -66.96 7.32 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.97 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.42 -45.09 95.78 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.401 HD21 ' NZ ' ' A' ' 16' ' ' LYS . 41.9 mt -69.12 -36.15 77.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.077 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 66' ' ' PHE . 0.1 OUTLIER -54.91 -40.27 69.67 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.705 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.8 t -56.04 -40.66 73.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.474 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -66.96 -38.47 86.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.064 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.4 t80 -57.5 -45.55 84.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.779 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.25 -34.85 75.49 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.276 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.905 0.383 . . . . 0.0 110.795 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -72.08 -44.96 62.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.698 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' A' ' 76' ' ' PHE . 91.0 mt -59.56 140.36 88.94 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.969 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.78 127.84 20.63 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.544 2.163 . . . . 0.0 112.512 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -85.87 57.87 4.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -155.29 53.85 0.62 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.5 -147.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.819 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.89 179.939 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.939 0.399 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.773 HG23 HD22 ' A' ' 35' ' ' LEU . 46.5 mm -64.14 -36.35 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.034 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 15.6 tm0? -55.82 -32.06 63.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.363 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.24 -45.75 91.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.086 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.599 HD23 ' HB1' ' A' ' 10' ' ' ALA . 66.1 mt -68.64 -46.21 69.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.058 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.72 -46.27 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -68.08 -37.26 81.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.552 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.76 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -58.52 -44.14 89.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.607 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.32 -43.16 96.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.395 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.14 -48.34 82.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 110.742 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -61.57 -56.58 18.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.387 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.479 HD13 ' CG2' ' A' ' 11' ' ' ILE . 22.5 tp -56.01 -48.59 75.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.752 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.928 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.335 0.112 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t 61.63 -82.83 0.02 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.175 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -66.3 126.78 29.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.873 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -68.94 145.95 53.2 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.078 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.438 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 86.0 t -59.57 -39.6 79.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.962 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 90.8 mt-10 -57.35 -34.74 69.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.846 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.525 ' O ' HG12 ' A' ' 11' ' ' ILE . 16.7 t80 -60.69 -60.33 3.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.294 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -62.03 -31.28 71.67 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 39.0 t-20 -57.43 -43.56 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.802 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.584 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.33 -39.11 68.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.834 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 7' ' ' PHE . 46.7 mm -54.42 -44.93 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.096 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.9 p -58.5 -33.51 69.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.835 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.584 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 34.1 t80 -63.0 -53.26 56.8 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.455 HG11 ' HA ' ' B' ' 9' ' ' ALA . 45.3 t -63.77 -40.06 87.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.929 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.14 -45.5 93.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.136 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.2 tttt -65.57 -39.35 91.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.541 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.0 mt -60.93 -41.17 87.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.511 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -65.5 -56.18 13.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.602 179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -60.08 -29.13 68.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.472 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -66.55 -55.37 15.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.918 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.701 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 51.1 m-85 -97.2 45.73 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.022 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.27 -43.31 64.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.87 0.367 . . . . 0.0 110.933 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.08 -22.03 45.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.624 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.701 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.9 m170 -109.69 72.19 0.58 Allowed Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.482 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -66.05 -34.85 36.3 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.495 2.13 . . . . 0.0 112.379 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -52.28 -34.49 46.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.412 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.29 -45.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.127 0.489 . . . . 0.0 110.423 -179.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.401 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.1 t80 -53.44 -49.45 67.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.327 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -60.09 -54.61 43.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.759 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.588 ' OG ' HD11 ' A' ' 65' ' ' LEU . 36.1 t -51.56 -49.94 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.232 -179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.471 ' CZ ' HD11 ' A' ' 35' ' ' LEU . 36.2 t80 -53.52 -50.18 65.98 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.907 0.384 . . . . 0.0 110.94 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 96.0 mt -59.18 -37.3 77.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -62.41 -35.97 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.942 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.582 HD11 HD12 ' A' ' 65' ' ' LEU . 56.8 mt -61.69 -56.91 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.142 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.573 HD22 HG23 ' B' ' 2' ' ' ILE . 89.0 mt -57.86 -39.13 77.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.345 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -62.2 -40.05 94.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.872 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.483 HG22 ' SD ' ' A' ' 53' ' ' MET . 99.8 m -60.49 -40.17 90.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.228 0.537 . . . . 0.0 110.155 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.499 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 52.2 t80 -63.68 -60.82 2.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.516 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -58.56 -43.94 89.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.632 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.568 ' HB3' ' NZ ' ' A' ' 40' ' ' LYS . 3.0 ttpm? -51.02 -52.53 42.08 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -71.72 -37.37 70.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.812 0.339 . . . . 0.0 111.351 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -51.05 -41.82 60.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.252 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.0 -85.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.831 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.99 34.89 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.942 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.4 p -79.2 -140.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.363 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -66.06 148.2 52.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.882 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.84 131.76 1.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.665 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' A' ' 48' ' ' ARG . 59.4 mtt85 -70.82 134.03 86.11 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.637 0.256 . . . . 0.0 111.33 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.491 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 54.9 Cg_endo -67.88 -156.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.598 2.199 . . . . 0.0 111.87 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.491 ' HB3' ' O ' ' A' ' 49' ' ' PRO . 22.9 t80 71.85 62.68 0.14 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.096 0.474 . . . . 0.0 110.9 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.491 ' HB3' ' O ' ' A' ' 50' ' ' PHE . 48.1 ttt-85 72.1 110.08 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.015 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -162.32 -38.63 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.21 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.09 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.483 ' SD ' HG22 ' A' ' 37' ' ' THR . 28.0 ttt -161.66 145.9 12.88 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.431 -0.385 . . . . 0.0 110.831 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.499 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 75.0 p -164.65 -143.76 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.643 ' HG3' HD22 ' A' ' 80' ' ' LEU . 8.6 mp0 -64.26 -28.87 70.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.728 0.299 . . . . 0.0 111.192 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -54.25 -46.95 72.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.791 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -81.42 -52.32 7.39 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.581 HG13 HG22 ' A' ' 34' ' ' ILE . 39.2 t -52.3 -47.38 45.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.689 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.568 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.1 t80 -59.89 -35.34 74.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.5 m -75.35 -52.74 10.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.021 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HA ' ' OE1' ' A' ' 61' ' ' GLU . 4.3 tp10 -57.1 -43.96 82.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.692 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.56 HG23 HG21 ' A' ' 34' ' ' ILE . 72.9 t -64.87 -45.25 95.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.246 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -58.95 -41.08 86.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.21 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -58.99 -39.91 83.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.196 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.588 HD11 ' OG ' ' A' ' 30' ' ' SER . 4.9 mt -69.18 -61.84 1.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.578 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 4.2 m-30 -73.73 38.38 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.649 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -58.59 133.76 56.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.61 -42.0 3.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.881 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.464 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.5 OUTLIER -77.91 52.3 1.04 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.871 0.367 . . . . 0.0 110.773 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -58.75 -15.26 11.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.65 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.48 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.6 p30 -60.92 -40.12 91.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.581 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 17' ' ' ILE . 97.6 mt -72.12 -40.77 67.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.001 0.429 . . . . 0.0 110.364 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.401 HD21 ' HA ' ' A' ' 63' ' ' ALA . 2.0 mm? -57.47 -33.64 68.19 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.062 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.541 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 35.3 t -58.14 -40.47 81.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.247 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -72.59 -44.73 61.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.522 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.584 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 11.8 t80 -57.23 -40.43 77.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.802 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.41 -34.14 86.95 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.079 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 74' ' ' SER . 86.3 mt-30 -49.66 -51.72 35.93 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.711 0.291 . . . . 0.0 111.469 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.529 ' HB3' ' OD1' ' B' ' 1' ' ' ASN . 3.2 m-85 -69.28 -44.81 71.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.201 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.643 HD22 ' HG3' ' A' ' 55' ' ' GLU . 82.0 mt -62.88 135.77 96.18 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.621 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.521 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 96.1 Cg_endo -78.33 58.88 6.86 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.831 2.354 . . . . 0.0 112.252 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -48.95 132.18 18.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.937 0.399 . . . . 0.0 111.308 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -109.66 -49.22 3.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -152.6 134.55 14.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.778 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.519 ' HD3' ' N ' ' A' ' 85' ' ' ARG . 1.2 mpp_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.775 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 79' ' ' PHE . 19.6 p30 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 121.133 0.492 . . . . 0.0 111.451 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.573 HG23 HD22 ' A' ' 35' ' ' LEU . 50.3 mm -75.12 -27.58 19.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -50.73 -37.53 42.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.604 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 59.6 mtt -58.56 -39.35 80.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.015 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.584 HD23 ' HB1' ' A' ' 10' ' ' ALA . 20.3 mt -71.7 -46.59 58.27 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.485 ' CD2' HG22 ' B' ' 2' ' ' ILE . 4.1 mm? -57.03 -42.51 80.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.518 0.675 . . . . 0.0 109.406 178.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -69.43 -36.51 76.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.856 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.495 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -61.32 -44.91 96.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.591 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.455 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.61 -41.73 73.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.876 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.87 -38.82 89.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.661 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -56.47 -54.0 50.81 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.972 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.36 -43.48 81.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.539 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.119 179.617 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.649 0.261 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.1 p -174.62 132.7 0.36 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.5 p-10 -173.69 -134.85 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.795 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.9 140.75 55.01 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.196 0.522 . . . . 0.0 111.188 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 85.3 t -63.76 -41.86 94.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.285 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 46.7 mt-10 -56.63 -36.76 69.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.63 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.471 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.8 t80 -59.15 -57.01 14.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.702 0.287 . . . . 0.0 110.519 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -33.11 75.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.442 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.6 t-20 -55.45 -41.01 72.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.651 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.686 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.92 -41.22 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.934 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.612 HD13 ' CB ' ' B' ' 8' ' ' ALA . 31.5 mm -50.91 -44.25 26.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.614 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 t -53.94 -41.61 67.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.506 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 17' ' ' ILE . 29.2 t80 -65.77 -56.61 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.829 0.347 . . . . 0.0 111.088 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.7 t -58.26 -43.49 86.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.341 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -58.07 -55.4 35.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.885 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.52 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.63 -38.97 64.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.4 mt -61.23 -43.14 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.557 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -65.03 -56.46 12.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.751 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.52 HG22 ' HA ' ' A' ' 16' ' ' LYS . 12.2 t -59.53 -31.62 69.57 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.818 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.5 tpt85 -68.78 -56.93 6.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.92 0.391 . . . . 0.0 111.359 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.479 ' CD2' HG13 ' A' ' 27' ' ' ILE . 70.9 m-85 -93.43 38.94 1.05 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.209 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 19' ' ' THR . 75.8 mt -53.94 -35.22 61.5 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 110.837 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -75.13 -38.9 60.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.888 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -106.33 79.82 0.64 Allowed Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.541 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 24.1 Cg_endo -58.84 -37.72 92.32 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.901 2.401 . . . . 0.0 112.651 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -48.58 -33.74 10.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.218 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.487 HG23 HD22 ' A' ' 65' ' ' LEU . 5.2 mm -64.43 -48.91 83.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.782 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.504 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.0 t80 -57.54 -50.84 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.87 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -56.21 -51.58 67.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.37 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.553 ' CB ' HD11 ' A' ' 65' ' ' LEU . 51.5 m -50.27 -50.5 50.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.071 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.2 t80 -53.35 -47.03 69.74 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.159 0.504 . . . . 0.0 110.611 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.3 mt -59.91 -42.69 94.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.354 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -61.55 -31.69 71.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.015 178.75 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.691 HG22 HG13 ' A' ' 58' ' ' VAL . 78.0 mt -60.63 -58.19 8.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.42 . . . . 0.0 109.935 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.844 HD22 HG23 ' B' ' 2' ' ' ILE . 89.5 mt -60.33 -38.57 84.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.3 m-70 -58.98 -40.81 85.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.707 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.568 HG22 ' SD ' ' A' ' 53' ' ' MET . 92.9 m -60.71 -36.3 78.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.075 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.541 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 50.2 t80 -60.88 -57.89 10.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.076 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.3 mm100 -62.22 -40.67 96.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.64 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.54 ' O ' HG23 ' A' ' 45' ' ' THR . 67.6 mttm -48.44 -52.82 20.35 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' ' OG1' ' A' ' 45' ' ' THR . 50.3 mt-10 -64.07 -39.83 94.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.665 0.269 . . . . 0.0 111.218 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.901 ' HA ' ' HB3' ' A' ' 49' ' ' PRO . 64.5 tt0 -64.48 -31.78 73.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.1 mt -56.59 -79.94 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.537 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.15 42.49 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.0 111.389 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 40' ' ' LYS . 42.9 p -69.39 -126.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.15 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -44.32 -38.3 3.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.357 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.08 -143.67 4.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.916 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.44 HH11 ' HG3' ' A' ' 48' ' ' ARG . 51.2 mtm-85 -75.83 144.98 77.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.708 0.289 . . . . 0.0 111.495 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.901 ' HB3' ' HA ' ' A' ' 42' ' ' GLN . 19.5 Cg_endo -59.87 -175.9 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.749 2.299 . . . . 0.0 112.528 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.487 ' HB2' ' O ' ' A' ' 49' ' ' PRO . 4.3 m-85 66.62 154.75 0.09 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.657 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 53.75 53.21 11.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.278 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.43 -40.04 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.201 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.908 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.568 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.9 ttt -167.42 139.53 3.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.719 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.7 m -150.08 -146.13 0.19 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.562 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.455 ' N ' ' OE1' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -70.76 -28.53 64.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 0.0 110.98 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.5 pt-20 -57.13 -50.88 71.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.019 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 5.0 tp10 -66.99 -50.12 63.22 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.639 0.257 . . . . 0.0 111.291 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.691 HG13 HG22 ' A' ' 34' ' ' ILE . 61.1 t -53.35 -41.43 44.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.744 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 16.7 t80 -60.83 -39.13 87.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.8 m -70.94 -47.92 56.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.719 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 5.1 mm-40 -57.7 -46.96 83.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 58' ' ' VAL . 68.6 t -64.3 -41.26 91.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.911 0.386 . . . . 0.0 110.0 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.78 -39.96 93.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.105 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -60.48 -41.19 93.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.217 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CB ' ' A' ' 30' ' ' SER . 4.7 mt -66.75 -64.27 0.89 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.361 0.601 . . . . 0.0 110.669 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.451 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.6 m-30 -76.31 42.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.138 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -57.86 134.22 56.12 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.452 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.94 -41.44 2.39 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.257 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -79.52 59.95 3.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.901 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -61.51 -6.05 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.113 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.607 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.0 p30 -61.5 -44.32 97.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.424 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.607 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 98.3 mt -72.62 -40.81 66.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.168 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 63' ' ' ALA . 1.0 OUTLIER -56.31 -35.83 68.0 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.206 179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 t -58.82 -39.94 82.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.468 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -70.57 -51.36 28.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.106 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.578 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 17.9 t80 -57.53 -39.6 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.133 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.48 -36.43 84.54 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.638 -0.71 . . . . 0.0 113.385 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -55.7 -45.93 77.75 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.915 0.357 . . . . 0.0 111.66 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -61.9 -47.9 82.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.995 0.426 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.784 HD21 HD11 ' B' ' 2' ' ' ILE . 25.2 mt -72.83 155.15 90.91 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.827 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.28 142.92 35.35 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.489 2.126 . . . . 0.0 111.86 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -46.36 -45.67 17.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.701 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -173.49 -137.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.981 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -149.14 -148.4 0.26 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.659 0.266 . . . . 0.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.012 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.76 0.314 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.844 HG23 HD22 ' A' ' 35' ' ' LEU . 41.2 mm -58.96 -37.69 68.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.785 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -54.65 -47.06 74.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.04 179.644 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 61.6 mtt -59.18 -49.5 77.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.981 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.686 HD23 ' HB1' ' A' ' 10' ' ' ALA . 87.5 mt -61.44 -48.06 82.88 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.938 0.399 . . . . 0.0 111.021 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' ' 35' ' ' LEU . 48.5 tp -61.5 -38.15 86.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 3' ' ' GLN . 4.1 tm-20 -67.18 -39.15 86.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.089 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.612 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -51.25 -43.58 61.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.786 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -57.08 -43.28 81.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -62.12 -40.61 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.644 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -59.09 -53.53 57.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.637 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.3 mt -64.62 -49.91 69.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.179 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.829 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.7 m 64.4 130.09 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.353 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -175.95 44.57 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.508 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.2 t -63.48 148.0 49.8 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.66 0.743 . . . . 0.0 112.52 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.587 ' HA ' ' ND2' ' A' ' 8' ' ' ASN . 71.0 t -56.35 -36.51 47.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.305 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -56.39 -38.0 70.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.089 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.584 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.4 t80 -65.42 -52.86 50.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.779 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.587 ' ND2' ' HA ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -65.22 -32.96 74.89 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.193 0.521 . . . . 0.0 110.32 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 2.6 t-20 -61.57 -41.01 96.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.543 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.99 -41.66 77.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.741 HD13 ' HB1' ' B' ' 8' ' ' ALA . 42.6 mm -54.8 -40.52 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.226 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.0 m -55.13 -39.66 69.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.452 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.667 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 17.0 t80 -68.73 -55.5 11.15 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.969 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.35 -37.26 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.938 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -64.03 -56.53 14.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.71 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.74 -40.12 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.504 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.667 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 79.1 mt -62.37 -45.74 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.632 ' HB2' ' HZ2' ' A' ' 18' ' ' LYS . 3.6 ttmp? -63.01 -55.87 21.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 16' ' ' LYS . 11.8 t -58.8 -32.59 69.49 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.472 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -68.31 -57.36 6.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.375 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -91.62 37.38 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.459 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 43.6 mt -56.54 -33.2 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.847 0.356 . . . . 0.0 110.729 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -74.71 -36.95 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.657 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.421 ' HB3' HG12 ' A' ' 27' ' ' ILE . 93.7 m-70 -106.37 78.9 0.56 Allowed Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.797 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.44 -37.89 95.96 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.886 2.391 . . . . 0.0 112.677 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.95 -33.43 17.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.295 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.449 HG23 HD22 ' A' ' 65' ' ' LEU . 5.5 mm -64.49 -53.5 41.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.019 0.438 . . . . 0.0 110.814 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.623 ' CE2' HD11 ' A' ' 32' ' ' LEU . 45.1 t80 -60.5 -49.44 77.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.934 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.406 HH11 ' HG2' ' A' ' 29' ' ' ARG . 50.2 mmt-85 -52.67 -52.68 54.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.182 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 34' ' ' ILE . 61.9 m -53.83 -49.32 68.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.977 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.582 ' HA ' HD12 ' A' ' 34' ' ' ILE . 62.0 t80 -51.65 -50.29 60.64 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.926 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.623 HD11 ' CE2' ' A' ' 28' ' ' TYR . 36.1 mt -57.82 -44.73 86.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.117 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 95.2 mt-10 -62.68 -30.04 71.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.763 HG22 HG13 ' A' ' 58' ' ' VAL . 76.9 mt -60.95 -56.49 17.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.944 0.402 . . . . 0.0 110.241 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.857 ' HB2' HD13 ' B' ' 6' ' ' LEU . 49.5 mt -64.53 -41.72 96.19 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.621 0.724 . . . . 0.0 109.17 178.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.644 ' HB3' ' NZ ' ' A' ' 40' ' ' LYS . 11.8 m-70 -55.84 -41.61 74.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.954 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 70.1 m -59.74 -36.43 76.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.384 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.504 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 62.0 t80 -60.84 -59.66 5.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.021 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.581 ' CD ' HD23 ' B' ' 6' ' ' LEU . 63.4 mt-30 -63.02 -36.6 84.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.096 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.644 ' NZ ' ' HB3' ' A' ' 36' ' ' HIS . 51.6 mttp -47.06 -35.51 6.98 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.85 -42.76 99.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.688 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -83.58 -50.2 8.46 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.64 13.18 0.39 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.622 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 69.1 m80 -154.14 40.26 0.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.84 0.352 . . . . 0.0 111.171 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.6 p -62.59 134.14 55.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.829 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HD2' ' HA ' ' A' ' 46' ' ' LYS . 14.6 tptm -172.55 -50.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.058 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.31 33.49 0.04 OUTLIER Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.453 -0.88 . . . . 0.0 112.978 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.473 HH11 ' HG3' ' A' ' 48' ' ' ARG . 52.6 mtt85 -75.52 142.1 73.84 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.661 0.267 . . . . 0.0 111.009 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.432 ' HB2' ' HG3' ' A' ' 51' ' ' ARG . 14.6 Cg_endo -57.09 129.77 36.12 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.618 2.212 . . . . 0.0 112.345 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.441 ' C ' ' H ' ' A' ' 52' ' ' GLY . 4.6 m-85 -81.25 52.83 1.9 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.403 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HG3' ' HB2' ' A' ' 49' ' ' PRO . 89.0 mtm180 -76.86 31.19 0.13 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.227 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . 65.03 135.89 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 115.946 -0.57 . . . . 0.0 113.182 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.5 tpt -169.0 126.82 0.99 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 120.837 0.351 . . . . 0.0 110.879 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.504 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.1 t -176.95 -138.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.129 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -33.82 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.026 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 22.5 pt-20 -59.85 -51.34 70.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.448 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 39.4 tp10 -67.84 -52.07 41.12 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.162 -0.215 . . . . 0.0 111.405 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.763 HG13 HG22 ' A' ' 34' ' ' ILE . 88.8 t -53.4 -42.56 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.061 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.611 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 23.4 t80 -63.6 -38.94 93.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 89.6 m -68.47 -48.72 63.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.838 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.448 ' OE1' HG23 ' A' ' 34' ' ' ILE . 93.0 mt-10 -57.28 -45.87 83.65 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.825 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 58' ' ' VAL . 64.8 t -64.58 -40.78 90.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.785 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.85 -39.89 90.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.039 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -64.44 -41.04 96.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.661 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.3 mt -64.04 -64.16 0.96 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.268 0.556 . . . . 0.0 111.298 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.611 ' HB2' HD23 ' A' ' 73' ' ' LEU . 6.2 m-30 -74.48 40.25 0.13 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.768 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -59.0 131.57 51.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 110.296 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.23 -43.38 2.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.966 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -86.03 52.62 2.53 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.937 0.399 . . . . 0.0 110.525 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 94.9 mt-10 -64.6 0.88 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.013 -179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -61.49 -47.98 83.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.077 0.465 . . . . 0.0 109.96 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.06 -33.64 68.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.966 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.74 -43.23 68.93 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.676 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 38.8 t -54.36 -40.49 68.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.696 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 49.4 mt-10 -63.35 -46.32 87.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.451 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 13.4 t80 -57.72 -44.68 86.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.54 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.73 -29.64 72.69 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.047 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 74' ' ' SER . 11.5 mm100 -47.73 -51.19 23.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.737 0.303 . . . . 0.0 111.483 -179.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -69.16 -43.16 74.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.753 HD21 HD11 ' B' ' 2' ' ' ILE . 53.1 mt -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.049 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 13.8 Cg_exo -68.02 123.71 10.96 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.471 2.114 . . . . 0.0 111.82 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 81' ' ' PRO . 88.5 tt0 178.74 64.12 0.01 OUTLIER 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.876 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.34 -44.88 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.434 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -59.59 -41.14 89.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.024 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.742 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 5.0 m120 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.921 0.391 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.759 HG23 HD22 ' A' ' 35' ' ' LEU . 40.2 mm -61.27 -39.87 84.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.165 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLN . . . . . 0.53 ' NE2' ' HG2' ' B' ' 4' ' ' MET . 1.8 pp0? -54.48 -35.05 62.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.655 0.264 . . . . 0.0 110.61 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' MET . . . . . 0.53 ' HG2' ' NE2' ' B' ' 3' ' ' GLN . 95.8 mmm -69.42 -45.82 68.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.649 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' B' ' 8' ' ' ALA . 20.2 tp -64.03 -49.2 73.33 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.936 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 35' ' ' LEU . 28.5 tp -59.86 -40.39 88.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.022 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -63.88 -37.3 86.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.741 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.6 -41.5 70.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.923 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.49 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -56.87 -46.22 81.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.72 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -59.03 -38.44 79.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.176 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.411 ' C ' ' H ' ' B' ' 13' ' ' GLU . 66.6 t80 -63.42 -44.47 94.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 11' ' ' ILE . 84.6 mt -75.86 24.7 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.715 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' B' ' 11' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.183 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.836 0.35 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -62.43 -48.86 77.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.052 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -175.2 42.43 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.998 0.428 . . . . 0.0 110.632 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -62.79 143.62 57.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.128 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.527 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 99.1 t -60.69 -39.58 82.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.051 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 47.6 mt-10 -54.13 -34.88 61.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.12 0.486 . . . . 0.0 109.783 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.575 ' O ' HG12 ' A' ' 11' ' ' ILE . 15.2 t80 -68.41 -56.04 9.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.981 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -62.86 -28.4 70.0 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.917 0.865 . . . . 0.0 108.953 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.527 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.1 t-20 -58.66 -46.05 88.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.041 -1.436 . . . . 0.0 109.683 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.19 -36.94 72.12 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.318 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.591 HD13 ' HB1' ' B' ' 8' ' ' ALA . 49.4 mm -52.57 -41.89 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.92 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.0 t -58.7 -37.64 76.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.191 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.632 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -63.26 -54.15 41.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.25 0.547 . . . . 0.0 109.741 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.468 HG11 ' HA ' ' B' ' 9' ' ' ALA . 53.1 t -60.36 -38.94 79.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.85 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -63.6 -47.28 82.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.391 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.521 ' HA ' HG22 ' A' ' 19' ' ' THR . 23.5 ttmm -63.28 -36.14 82.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.592 HG12 HD13 ' A' ' 72' ' ' LEU . 81.2 mt -64.66 -42.55 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.823 0.344 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 28.7 mtpp -62.29 -46.6 88.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 110.783 179.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.522 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -71.27 -29.45 65.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.529 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -67.14 -56.02 11.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.547 ' CD2' HG13 ' A' ' 27' ' ' ILE . 73.1 m-85 -95.48 42.09 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 19' ' ' THR . 77.9 mt -54.97 -36.6 65.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.331 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -75.66 -38.47 58.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.885 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -105.86 78.15 0.45 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.198 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.45 -33.65 93.8 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.75 2.3 . . . . 0.0 112.518 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -53.51 -30.21 40.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.547 HG13 ' CD2' ' A' ' 21' ' ' PHE . 6.9 mm -64.19 -51.95 62.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.837 0.351 . . . . 0.0 111.017 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.622 ' CE2' HD11 ' A' ' 32' ' ' LEU . 62.7 t80 -57.08 -46.1 82.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.823 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.503 HH11 ' HA ' ' A' ' 29' ' ' ARG . 3.8 mmm180 -55.68 -56.11 24.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.618 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.661 ' HB2' HD11 ' A' ' 65' ' ' LEU . 50.9 m -54.64 -49.88 69.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.21 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -49.15 -47.11 45.98 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.027 0.442 . . . . 0.0 110.825 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.622 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.0 mt -60.09 -40.69 90.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.555 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -63.4 -36.81 84.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.48 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.526 HG21 HG23 ' A' ' 62' ' ' VAL . 75.3 mt -60.07 -56.32 18.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.749 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.686 HD22 HG23 ' B' ' 2' ' ' ILE . 83.4 mt -59.02 -44.41 91.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.326 0.584 . . . . 0.0 109.468 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.581 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -54.96 -42.68 72.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.708 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.636 HG22 ' SD ' ' A' ' 53' ' ' MET . 98.8 m -55.66 -39.04 70.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' HB2' ' CG2' ' A' ' 58' ' ' VAL . 42.2 t80 -65.25 -57.19 9.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.951 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.571 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 50.7 mm-40 -52.45 -34.48 48.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.727 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.813 ' HA ' ' HE3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -53.3 -49.88 66.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.266 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -42.66 83.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.332 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.594 ' O ' HG23 ' A' ' 45' ' ' THR . 64.9 tt0 -57.93 -33.38 68.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.54 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.7 mt -56.02 -47.18 78.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.777 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -116.26 53.6 0.86 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.648 -179.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.594 HG23 ' O ' ' A' ' 42' ' ' GLN . 57.8 p -60.41 132.4 53.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.821 0.343 . . . . 0.0 111.349 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.543 ' HD2' ' N ' ' A' ' 46' ' ' LYS . 11.8 mptt -81.11 46.1 0.89 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.721 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.46 -96.88 0.36 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.604 -0.808 . . . . 0.0 112.169 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -59.76 143.61 86.77 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.759 0.314 . . . . 0.0 110.789 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.42 136.32 70.94 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.814 2.343 . . . . 0.0 112.513 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -119.94 144.17 47.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.791 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.415 HH11 ' HG3' ' A' ' 51' ' ' ARG . 53.2 mtm-85 -76.34 35.1 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.882 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.94 -46.36 7.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.425 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.636 ' SD ' HG22 ' A' ' 37' ' ' THR . 26.5 ttt -168.96 147.36 3.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.3 -0.45 . . . . 0.0 110.685 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 58' ' ' VAL . 18.7 t -162.54 -154.57 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.542 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -62.97 -31.38 72.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.729 0.3 . . . . 0.0 111.076 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.2 pt-20 -61.3 -51.15 70.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.734 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 18.4 tt0 -69.04 -45.34 70.67 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.364 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.616 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.5 t -56.91 -44.14 81.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 0.0 110.375 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.7 t80 -64.24 -37.93 89.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.724 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.9 m -65.47 -55.27 18.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.11 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 59.3 mm-40 -57.54 -46.5 83.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.526 HG23 HG21 ' A' ' 34' ' ' ILE . 85.8 t -64.0 -41.35 92.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.912 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.9 -41.09 95.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.14 0.495 . . . . 0.0 109.931 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -60.08 -44.56 94.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.553 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.661 HD11 ' HB2' ' A' ' 30' ' ' SER . 3.1 mt -63.17 -61.56 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.334 0.588 . . . . 0.0 110.605 179.003 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.425 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 6.4 m-30 -72.94 36.94 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.486 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 65' ' ' LEU . 29.5 tpt85 -59.6 129.46 42.03 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -36.14 2.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.371 -0.918 . . . . 0.0 111.553 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -78.28 42.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.836 0.35 . . . . 0.0 110.17 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.677 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 6.3 tt0 -53.99 -11.68 0.48 Allowed 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -60.69 -49.4 77.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.87 0.367 . . . . 0.0 110.074 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 17' ' ' ILE . 82.3 mt -72.49 -34.38 67.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.541 . . . . 0.0 110.058 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.912 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -52.04 -42.32 63.02 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.107 -179.652 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 t -56.87 -41.13 77.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.257 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.718 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 90.7 mt-10 -67.99 -46.63 70.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.034 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.4 t80 -58.35 -41.48 84.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.1 -42.79 99.91 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.421 -0.809 . . . . 0.0 114.069 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.718 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.3 pt20 -54.87 -40.93 70.23 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 117.238 0.519 . . . . 0.0 111.211 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HE1' HE21 ' A' ' 78' ' ' GLN . 7.4 m-85 -62.17 -46.71 87.74 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 120.991 0.424 . . . . 0.0 110.411 179.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 73.7 mt -62.93 148.16 92.71 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.657 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.1 143.09 42.68 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.518 2.145 . . . . 0.0 112.128 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -157.0 64.52 0.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.92 0.391 . . . . 0.0 110.991 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 65.11 51.78 1.61 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.5 tttm 64.83 134.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.101 0.477 . . . . 0.0 111.801 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.503 ' HG3' HH11 ' A' ' 85' ' ' ARG . 28.7 tpt85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.757 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.937 0.398 . . . . 0.0 111.304 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.686 HG23 HD22 ' A' ' 35' ' ' LEU . 51.4 mm -65.59 -39.53 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -57.41 -33.85 68.31 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.1 mmt -59.15 -39.44 82.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.473 HD23 ' HB1' ' A' ' 10' ' ' ALA . 35.1 mt -72.14 -45.77 59.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.548 ' HG ' ' HG3' ' A' ' 39' ' ' GLN . 3.3 mm? -56.8 -42.72 80.01 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.453 0.645 . . . . 0.0 109.265 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.93 -37.19 72.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.154 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.591 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -62.65 -47.19 84.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.03 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.468 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.86 -43.21 76.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.321 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.64 -38.96 89.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.715 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.47 ' HD2' HD12 ' A' ' 11' ' ' ILE . 37.1 t80 -62.23 -54.95 33.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.746 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.413 HD21 ' CG2' ' A' ' 11' ' ' ILE . 95.5 mt -62.41 -51.33 67.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.627 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.909 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.724 0.297 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m 56.31 44.15 25.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.789 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -173.78 50.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.467 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p -56.65 147.5 22.43 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.441 0.639 . . . . 0.0 112.106 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.592 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 69.7 t -55.33 -39.34 51.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.081 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.0 mt-10 -59.45 -38.6 81.18 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.139 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.475 ' O ' HG12 ' A' ' 11' ' ' ILE . 20.6 t80 -60.76 -58.22 9.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.429 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.29 -28.83 69.99 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.592 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.2 t-20 -58.13 -44.06 87.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.347 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.21 -45.43 60.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.188 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.622 HD13 ' HB1' ' B' ' 8' ' ' ALA . 40.3 mm -53.35 -45.48 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.261 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -58.29 -35.37 71.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.114 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 38.7 t80 -63.35 -55.83 21.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.195 0.521 . . . . 0.0 109.815 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' B' ' 8' ' ' ALA . 36.9 t -60.73 -38.02 77.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.453 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.57 -41.08 96.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.691 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.4 ttmt -66.77 -38.72 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.125 0.488 . . . . 0.0 110.121 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 84.8 mt -62.11 -42.83 96.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.68 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -65.28 -54.78 24.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.641 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.6 t -59.64 -31.27 69.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.569 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -68.11 -52.42 35.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.115 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.616 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 78.2 m-85 -98.3 44.17 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.026 -179.322 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 85.2 mt -56.39 -42.41 77.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.854 0.359 . . . . 0.0 110.546 179.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -76.21 -23.72 54.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.157 0.503 . . . . 0.0 109.86 179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.616 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.3 m170 -108.99 73.06 0.5 Allowed Pre-proline 0 CA--C 1.535 0.366 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.351 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.39 -34.59 43.2 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.639 2.226 . . . . 0.0 112.46 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -53.91 -35.25 61.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.427 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.607 ' CG1' ' HB3' ' A' ' 24' ' ' HIS . 1.0 OUTLIER -64.29 -51.65 65.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.556 -179.697 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 54.9 t80 -56.9 -47.24 81.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.95 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -55.61 -54.6 42.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.277 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.554 ' O ' HG13 ' A' ' 34' ' ' ILE . 44.7 t -54.16 -48.12 71.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.606 ' HA ' HD12 ' A' ' 34' ' ' ILE . 49.0 t80 -52.33 -47.52 65.98 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.99 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 66.4 mt -60.09 -41.42 92.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 39.3 tt0 -63.77 -30.02 71.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.689 HG22 HG13 ' A' ' 58' ' ' VAL . 79.6 mt -62.47 -56.71 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.124 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.052 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.749 HD22 HG23 ' B' ' 2' ' ' ILE . 78.3 mt -61.82 -36.26 80.64 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.5 0.667 . . . . 0.0 109.232 178.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.586 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 5.1 m-70 -59.95 -48.06 83.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.901 179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.563 HG22 ' SD ' ' A' ' 53' ' ' MET . 99.5 m -60.49 -36.59 78.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.239 179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.586 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 41.5 t80 -53.95 -57.76 9.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.568 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.6 mm100 -60.9 -42.55 98.24 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.091 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 34.5 mmtp -53.86 -44.48 70.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.367 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG2' ' HB3' ' A' ' 53' ' ' MET . 5.6 tp10 -69.66 -35.99 75.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.649 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -68.38 -31.42 70.78 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 88.4 mt -71.81 121.97 19.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.415 ' HB3' ' O ' ' A' ' 43' ' ' LEU . 15.4 p-80 168.3 135.2 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.262 0.351 . . . . 0.0 111.124 179.099 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.8 p -118.51 132.79 56.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.697 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 60.23 123.16 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.49 145.15 4.08 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.575 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.39 133.77 62.05 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.533 0.206 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -63.96 148.99 91.51 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.597 2.198 . . . . 0.0 112.297 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.6 166.83 23.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.304 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -45.53 -33.17 2.6 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.214 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 55.89 -132.4 50.32 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.979 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.563 ' SD ' HG22 ' A' ' 37' ' ' THR . 25.2 ttt -167.03 144.51 4.75 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.618 -0.291 . . . . 0.0 110.809 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.505 ' O ' HG23 ' A' ' 58' ' ' VAL . 75.6 m -157.81 -145.76 0.15 Allowed 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.231 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.833 ' HG2' ' HD2' ' A' ' 81' ' ' PRO . 9.1 mp0 -60.22 -33.52 72.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.752 0.31 . . . . 0.0 110.999 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -54.04 -44.42 71.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.338 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.467 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 37.2 tp10 -82.21 -51.89 7.5 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 34' ' ' ILE . 44.6 t -52.94 -43.11 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.639 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 40.2 t80 -61.15 -36.88 80.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.875 0.369 . . . . 0.0 110.302 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.408 HG22 ' OD1' ' A' ' 64' ' ' ASN . 88.1 m -71.79 -48.39 46.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.475 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -56.78 -48.07 78.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.932 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.56 -41.85 93.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.068 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.663 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.7 -39.03 83.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.85 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.408 ' OD1' HG22 ' A' ' 60' ' ' THR . 22.6 m120 -63.91 -37.98 89.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.347 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 30' ' ' SER . 5.8 mt -70.56 -66.28 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.512 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.561 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.0 m-30 -74.55 38.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.087 -178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -66.4 138.49 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.549 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.31 -44.53 2.79 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.527 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.523 ' C ' ' H ' ' A' ' 71' ' ' ASP . 0.7 OUTLIER -68.47 -62.95 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.82 0.343 . . . . 0.0 110.573 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.6 mt-10 59.98 -15.94 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.523 ' H ' ' C ' ' A' ' 69' ' ' GLN . 34.4 t70 -61.99 -49.17 77.15 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-O 121.096 0.474 . . . . 0.0 109.897 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.3 mt -68.84 -36.35 78.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.834 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.664 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -54.59 -39.35 67.74 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.68 179.858 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.591 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 37.4 t -55.44 -41.96 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.738 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.66 -42.77 77.44 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.539 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.626 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 20.1 t80 -57.28 -44.22 83.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.846 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.02 -38.36 95.41 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.59 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 74' ' ' SER . 76.8 mt-30 -54.71 -45.3 74.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.885 0.374 . . . . 0.0 110.906 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -66.85 -44.53 80.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.003 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.62 HD21 HD11 ' B' ' 2' ' ' ILE . 85.8 mt -65.48 131.75 94.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.378 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.833 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 16.2 Cg_exo -66.87 147.78 81.19 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.806 2.338 . . . . 0.0 111.786 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -64.83 -151.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.222 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -177.06 44.87 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.81 0.338 . . . . 0.0 111.196 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -62.08 139.34 58.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.459 ' HD2' ' C ' ' A' ' 85' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.2 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 6.4 m120 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.648 0.261 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 35' ' ' LEU . 48.1 mm -52.73 -24.56 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.141 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -55.4 -58.13 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.485 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -79.77 -27.99 40.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' B' ' 2' ' ' ILE . 0.9 OUTLIER -58.87 -45.95 88.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.845 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.729 HD13 ' HB2' ' A' ' 35' ' ' LEU . 43.1 tp -77.77 -44.46 27.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 tp10 -56.52 -33.16 65.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.653 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.622 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.71 -41.95 82.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.357 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.48 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.47 -47.68 78.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.442 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.98 -38.88 83.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -59.53 -54.77 42.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.849 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.87 -48.83 80.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.903 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 12.5 pt-20 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.787 0.327 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p -177.26 -146.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.373 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 63.45 148.51 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.895 0.379 . . . . 0.0 111.482 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -51.17 144.1 9.85 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.123 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.553 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 92.9 t -58.67 -40.71 80.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.386 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.463 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 91.7 mt-10 -58.23 -38.96 77.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.585 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.48 ' O ' HG12 ' A' ' 11' ' ' ILE . 13.4 t80 -59.92 -56.58 20.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.747 0.308 . . . . 0.0 110.702 -179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.06 -31.07 72.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.563 0.696 . . . . 0.0 109.153 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.553 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.4 t-20 -56.88 -43.15 81.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.661 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.723 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -69.56 -39.79 77.2 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.278 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.506 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.4 mm -53.79 -42.76 53.7 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.416 179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 m -55.58 -37.97 68.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.823 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.553 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.9 t80 -64.84 -58.08 7.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.847 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.541 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.6 t -58.88 -45.09 91.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.396 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -61.07 -54.58 42.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.042 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.455 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.8 tttt -53.64 -37.42 63.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.197 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.607 HG12 HD13 ' A' ' 72' ' ' LEU . 95.5 mt -64.84 -37.26 79.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.002 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -65.54 -47.59 75.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.426 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.3 t -70.98 -26.99 63.39 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.754 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HG2' HD11 ' A' ' 72' ' ' LEU . 19.5 tpp180 -64.77 -58.07 7.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.318 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.794 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 61.6 m-85 -94.89 46.42 1.13 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.427 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.5 mt -55.45 -40.74 71.96 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.811 0.338 . . . . 0.0 110.796 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.38 -19.35 46.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.094 0.473 . . . . 0.0 110.156 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.794 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 58.1 m170 -110.33 74.06 0.82 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.354 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.72 -35.61 56.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.589 2.193 . . . . 0.0 112.55 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -52.17 -36.47 51.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.639 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.46 -48.35 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 110.701 -179.738 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.619 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 55.3 t80 -56.92 -51.36 69.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.118 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 29' ' ' ARG . 21.5 mmt85 -56.9 -54.29 48.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.493 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 57.0 m -52.85 -49.56 65.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.626 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.9 t80 -53.54 -49.81 66.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 110.959 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.633 HD22 ' HB2' ' B' ' 9' ' ' ALA . 41.2 mt -58.1 -39.78 79.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.161 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.59 -29.53 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.201 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.685 HD11 HD12 ' A' ' 65' ' ' LEU . 82.9 mt -61.75 -59.53 4.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.57 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.801 HD22 HG23 ' B' ' 2' ' ' ILE . 86.3 mt -60.3 -38.79 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.661 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 1.1 m-70 -59.74 -42.79 93.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.242 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.401 ' HA ' ' HD2' ' A' ' 40' ' ' LYS . 75.3 m -60.53 -39.12 86.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.481 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 46.6 t80 -55.16 -58.87 5.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.667 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.544 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 11.0 mm100 -55.27 -38.5 68.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.046 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 67.2 mttm -47.3 -42.85 21.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.792 0.329 . . . . 0.0 111.101 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -70.73 -45.72 64.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.106 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 44' ' ' HIS . 9.7 mp0 -77.75 18.61 0.45 Allowed 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 71.5 mt -77.76 30.1 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.831 0.348 . . . . 0.0 111.183 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.432 ' H ' ' C ' ' A' ' 42' ' ' GLN . 2.9 m-70 -128.15 -128.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.814 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.8 p -145.26 39.31 1.19 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -152.36 145.57 24.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.625 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -149.43 34.07 1.08 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.24 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -80.74 147.44 62.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.672 0.272 . . . . 0.0 110.668 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -56.45 132.09 49.69 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.651 2.234 . . . . 0.0 111.737 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.447 ' C ' ' H ' ' A' ' 52' ' ' GLY . 2.7 t80 -172.52 -166.73 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.284 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 51' ' ' ARG . 54.3 ttp180 -71.25 10.58 0.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.148 0.499 . . . . 0.0 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.447 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . -75.38 -126.42 0.19 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.656 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.3 ttt -156.93 149.16 23.05 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.534 -0.333 . . . . 0.0 111.087 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.465 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 81.3 p -164.93 -142.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.275 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.83 -30.69 71.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.892 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.5 pt-20 -54.8 -50.18 69.17 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 5.0 tp10 -72.9 -49.44 29.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.581 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.8 t -52.63 -40.68 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.396 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.49 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 22.5 t80 -60.38 -40.22 90.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.561 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.3 m -73.59 -44.8 56.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.407 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.663 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -57.29 -47.77 80.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.232 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.66 -42.93 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.947 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -62.21 -44.81 95.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.134 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.663 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -64.12 -40.87 97.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.87 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.685 HD12 HD11 ' A' ' 34' ' ' ILE . 3.2 mt -60.98 -61.0 2.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.829 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.461 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 6.6 m-30 -72.95 38.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.826 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.2 ttm-85 -60.2 127.88 34.01 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.49 -43.23 2.78 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.802 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -86.43 49.84 1.88 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.94 0.4 . . . . 0.0 110.453 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.8 mt-10 -60.63 -8.52 2.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.732 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -61.16 -45.68 93.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.93 0.395 . . . . 0.0 109.942 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.607 HD13 HG12 ' A' ' 17' ' ' ILE . 94.4 mt -72.15 -32.63 67.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.919 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.947 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.28 -42.53 73.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.738 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.49 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 44.3 t -53.79 -39.94 65.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.234 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -68.0 -41.53 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.608 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 12.4 t80 -56.54 -43.55 79.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.246 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.13 -32.87 83.95 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.26 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 74' ' ' SER . 94.0 mm-40 -56.39 -47.31 79.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.858 0.361 . . . . 0.0 111.001 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.409 ' HB3' ' OD1' ' B' ' 1' ' ' ASN . 3.0 m-85 -70.35 -44.55 67.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.169 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 76' ' ' PHE . 93.7 mt -57.08 126.46 73.45 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.978 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.32 129.69 17.43 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.538 2.159 . . . . 0.0 112.356 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -70.82 132.95 46.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.4 -166.65 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 61.74 134.89 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.421 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.483 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 9.0 mpt_? . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.757 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.409 ' OD1' ' HB3' ' A' ' 79' ' ' PHE . 23.8 t-20 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.903 0.382 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.801 HG23 HD22 ' A' ' 35' ' ' LEU . 37.7 mm -64.4 -34.45 69.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.785 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 13.5 tm0? -51.64 -35.13 40.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.233 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 24.9 mmt -63.14 -50.39 70.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.591 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.723 HD23 ' HB1' ' A' ' 10' ' ' ALA . 81.9 mt -65.95 -46.91 76.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' ' 35' ' ' LEU . 41.4 tp -61.17 -47.22 87.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.27 -35.51 80.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.418 . . . . 0.0 110.184 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.541 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -52.98 -38.57 62.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.917 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.633 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -57.66 -48.27 79.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.134 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.6 -38.73 91.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.629 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -57.94 -54.24 49.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.55 -49.55 70.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.221 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.889 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.567 0.222 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.6 m 54.94 44.91 27.52 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.798 0.332 . . . . 0.0 111.041 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 58.17 54.83 5.53 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.741 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 m -51.76 142.49 14.81 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.262 0.553 . . . . 0.0 111.366 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.535 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 92.0 t -60.65 -41.92 89.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.549 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 89.4 mt-10 -57.76 -38.47 75.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.642 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.525 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.0 t80 -59.98 -57.43 12.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.889 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -31.28 72.33 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.569 0.699 . . . . 0.0 109.374 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.535 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.5 t-20 -55.66 -42.94 75.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.552 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.21 -44.42 62.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.981 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.742 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.6 mm -53.15 -43.06 48.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.046 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -57.15 -38.47 73.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.028 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.592 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 25.1 t80 -63.88 -55.97 18.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.088 0.47 . . . . 0.0 110.768 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.9 t -57.1 -45.0 84.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.378 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -57.69 -56.32 23.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.111 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.2 tttt -52.99 -36.53 60.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.518 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.592 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 76.9 mt -64.19 -41.12 91.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.268 179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -64.17 -55.48 21.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.507 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.3 t -59.22 -31.18 68.81 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.396 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH2' ' HG3' ' A' ' 69' ' ' GLN . 10.8 tpt180 -68.11 -56.09 10.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.909 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 27' ' ' ILE . 55.8 m-85 -93.98 41.31 1.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.989 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.0 mt -56.96 -35.36 69.03 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.996 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -74.95 -39.95 61.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.021 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -107.74 77.24 0.61 Allowed Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.356 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.99 -33.74 95.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.593 2.195 . . . . 0.0 112.395 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -51.2 -34.11 30.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.491 HG21 ' CE2' ' A' ' 21' ' ' PHE . 3.8 mm -64.37 -45.99 94.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.167 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 59.8 t80 -58.82 -49.39 77.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -56.24 -55.49 32.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.466 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.553 ' O ' HG13 ' A' ' 34' ' ' ILE . 18.5 p -53.02 -49.01 67.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.325 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.557 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.8 t80 -51.2 -45.25 61.78 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.878 0.37 . . . . 0.0 110.435 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 64.9 mt -62.93 -49.51 74.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -53.65 -29.39 38.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.481 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.696 HG22 HG13 ' A' ' 58' ' ' VAL . 84.3 mt -61.26 -49.62 83.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.104 0.478 . . . . 0.0 110.135 179.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.762 HD22 HG23 ' B' ' 2' ' ' ILE . 58.2 mt -66.15 -40.97 90.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.594 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -60.26 -38.86 84.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.21 178.667 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.655 HG22 ' SD ' ' A' ' 53' ' ' MET . 87.1 m -60.94 -36.84 80.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.621 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.641 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 78.5 t80 -59.07 -60.3 4.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.012 179.058 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' OE1' ' HD2' ' A' ' 38' ' ' TYR . 2.7 mp0 -52.41 -31.75 35.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 48.4 mmtm -59.69 -75.7 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -81.98 38.04 0.51 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.639 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.525 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 21.9 pt20 -67.27 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.783 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.525 ' N ' ' HG3' ' A' ' 42' ' ' GLN . 0.2 OUTLIER -62.19 -120.26 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.586 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.434 ' H ' ' HB2' ' A' ' 43' ' ' LEU . 24.6 m170 71.41 38.96 0.97 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.432 0.634 . . . . 0.0 109.898 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 p 48.23 -150.28 0.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.681 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.533 ' HD2' ' N ' ' A' ' 46' ' ' LYS . 12.3 mptt -96.49 151.24 19.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.134 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -159.59 -131.04 1.2 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.424 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.409 HH11 ' HG2' ' A' ' 48' ' ' ARG . 73.2 mtt-85 -56.13 141.95 67.56 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.711 0.291 . . . . 0.0 110.984 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.97 134.1 60.11 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.681 2.254 . . . . 0.0 112.295 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -173.9 147.72 1.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.647 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 5.8 tpm_? -58.28 -9.27 1.43 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.145 0.498 . . . . 0.0 111.151 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.0 135.1 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.75 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.655 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.1 ttt -101.06 149.09 24.31 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.418 -0.391 . . . . 0.0 111.164 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.641 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 79.8 p -163.09 -148.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.732 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -68.51 -32.62 72.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.035 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.457 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 11.6 pt-20 -61.78 -48.11 82.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.581 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 68.5 tt0 -66.85 -47.66 71.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.595 0.236 . . . . 0.0 111.196 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.696 HG13 HG22 ' A' ' 34' ' ' ILE . 66.9 t -57.96 -43.15 84.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.984 0.421 . . . . 0.0 110.513 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.635 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.3 t80 -62.86 -39.44 94.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.944 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -66.14 -49.67 66.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -57.33 -45.29 84.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.016 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 58' ' ' VAL . 80.7 t -64.48 -40.83 90.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.054 179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.89 -41.66 98.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.098 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -62.01 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.532 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.604 HD12 HD11 ' A' ' 34' ' ' ILE . 5.8 mt -67.64 -65.06 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.431 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.525 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 5.9 m-30 -73.43 38.86 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.638 -179.071 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -58.76 132.62 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.23 -43.32 3.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.791 -178.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.8 OUTLIER -79.93 51.23 1.3 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.81 0.338 . . . . 0.0 110.587 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.1 mt-10 -61.72 -4.33 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.051 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.72 -50.61 71.75 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.964 0.411 . . . . 0.0 110.066 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.58 -36.28 73.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.981 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.92 -40.85 70.29 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.64 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.9 t -56.3 -40.35 74.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.562 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.29 -38.91 71.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.088 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.635 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.6 t80 -57.51 -43.24 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.005 0.431 . . . . 0.0 110.233 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.21 -31.41 78.96 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.364 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -50.63 -48.53 58.05 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.801 0.334 . . . . 0.0 111.018 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -69.86 -43.26 72.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.556 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 75.5 mt -61.07 131.52 91.97 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.739 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 Cg_exo -68.92 -171.19 0.38 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.466 2.111 . . . . 0.0 112.087 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.446 ' HB3' ' O ' ' A' ' 81' ' ' PRO . 39.1 tt0 72.44 -39.9 0.46 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.943 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.63 -147.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.652 0.263 . . . . 0.0 111.398 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp 63.59 134.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.998 0.428 . . . . 0.0 111.156 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.801 179.995 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.762 HG23 HD22 ' A' ' 35' ' ' LEU . 40.6 mm -62.88 -39.33 84.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.41 -34.34 64.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.511 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 45.8 ttm -63.26 -49.92 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.256 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.552 HD23 ' HB1' ' A' ' 10' ' ' ALA . 68.6 mt -68.46 -46.72 69.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.955 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.462 HD13 ' HB2' ' A' ' 35' ' ' LEU . 63.0 tp -56.85 -44.46 82.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.556 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -68.27 -39.58 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.615 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.742 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.67 -40.49 79.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.15 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.438 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -61.9 -40.65 96.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.279 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -64.01 -44.22 93.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.793 0.33 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -64.05 -58.67 5.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.473 0.654 . . . . 0.0 110.776 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.414 HD13 HG23 ' A' ' 11' ' ' ILE . 21.2 tp -57.95 -36.97 73.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.43 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.922 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.548 0.213 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 82.5 p -173.49 132.76 0.47 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.839 0.352 . . . . 0.0 110.863 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -70.77 -133.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.004 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -58.39 141.6 50.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.179 0.514 . . . . 0.0 111.257 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 82.8 t -62.69 -42.27 95.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.494 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 47.3 mt-10 -56.4 -37.76 70.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.611 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.561 ' O ' HG12 ' A' ' 11' ' ' ILE . 22.1 t80 -60.01 -57.71 11.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.882 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.59 -33.27 75.53 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.645 0.735 . . . . 0.0 109.321 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 38.5 t-20 -54.45 -43.83 71.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.891 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.57 -41.5 65.66 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.242 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.744 HD13 ' HB1' ' B' ' 8' ' ' ALA . 47.0 mm -51.75 -47.15 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.373 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -55.54 -36.61 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.183 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.577 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 26.5 t80 -62.46 -54.27 42.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.191 0.519 . . . . 0.0 109.68 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' B' ' 9' ' ' ALA . 61.2 t -57.75 -40.12 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.542 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.64 -53.03 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.437 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 61.3 tttp -58.14 -36.72 73.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.937 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 13' ' ' TYR . 89.1 mt -61.43 -38.47 80.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.987 0.422 . . . . 0.0 110.286 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 29.6 mtpp -64.55 -45.22 88.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.255 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.605 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -74.83 -28.66 60.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.909 -179.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.51 -56.47 15.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.974 0.416 . . . . 0.0 111.143 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.663 ' CD2' HG13 ' A' ' 27' ' ' ILE . 50.6 m-85 -97.11 48.21 1.05 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.3 mt -52.71 -40.46 63.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.692 0.282 . . . . 0.0 111.111 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -77.31 -27.32 52.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.189 0.519 . . . . 0.0 110.036 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 63.6 m170 -109.76 73.41 0.66 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.735 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -65.82 -32.71 45.62 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.311 2.007 . . . . 0.0 112.126 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -54.91 -32.09 60.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.512 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.663 HG13 ' CD2' ' A' ' 21' ' ' PHE . 2.4 mm -63.81 -48.53 85.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.958 0.409 . . . . 0.0 110.345 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.569 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.8 t80 -56.81 -48.98 76.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.532 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -56.95 -54.9 41.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.452 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.569 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.9 m -53.05 -46.43 68.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.934 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.436 ' HA ' HD12 ' A' ' 34' ' ' ILE . 43.7 t80 -52.63 -48.07 66.63 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.002 0.429 . . . . 0.0 110.699 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 48.9 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.284 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.545 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.0 mm-40 -61.68 -31.79 71.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.18 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 30' ' ' SER . 68.0 mt -62.23 -55.81 21.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.429 . . . . 0.0 109.898 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.835 ' HB2' HD13 ' B' ' 6' ' ' LEU . 43.1 mt -60.58 -39.69 88.96 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.545 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -58.07 -42.83 86.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.596 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.472 HG22 ' SD ' ' A' ' 53' ' ' MET . 89.4 m -59.65 -34.06 72.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.307 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.543 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 49.2 t80 -62.74 -62.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.208 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.575 ' CD ' HD23 ' B' ' 6' ' ' LEU . 56.8 mt-30 -60.26 -43.18 96.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.274 -179.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 59.7 mtpt -54.02 -41.23 67.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.692 0.282 . . . . 0.0 111.574 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -71.47 -49.74 38.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 2.8 pt20 -60.95 -39.9 91.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -178.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 97.3 mt -57.78 134.06 55.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.998 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.45 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 25.5 m170 76.8 48.67 0.06 Allowed 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.5 m -52.13 140.08 21.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.28 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 44' ' ' HIS . 34.5 mmtp -135.41 -54.59 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.32 -147.84 1.77 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.373 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.8 mtm105 -77.65 138.96 62.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.72 122.79 12.26 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.382 2.055 . . . . 0.0 111.789 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 63.89 122.29 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.04 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -177.89 -46.49 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.452 0.644 . . . . 0.0 111.079 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.75 -128.37 0.32 Allowed Glycine 0 C--N 1.311 -0.81 0 CA-C-N 114.757 -1.11 . . . . 0.0 113.064 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.472 ' SD ' HG22 ' A' ' 37' ' ' THR . 26.2 ttt -66.68 145.6 55.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.033 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 58' ' ' VAL . 20.6 t -159.02 -150.22 0.23 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -65.07 -32.23 73.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.898 0.38 . . . . 0.0 110.955 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.0 pt-20 -60.0 -50.11 75.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.793 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.497 ' O ' ' HB ' ' A' ' 60' ' ' THR . 29.9 tt0 -73.61 -47.31 41.21 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 54' ' ' SER . 97.5 t -53.38 -44.78 55.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.98 0.419 . . . . 0.0 110.294 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.5 t80 -61.34 -30.75 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.271 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 58.5 m -66.76 -62.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.399 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 57' ' ' GLU . 8.8 mp0 -57.06 -41.46 78.77 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 58' ' ' VAL . 99.3 t -63.65 -44.34 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.729 0.3 . . . . 0.0 110.428 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.702 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.29 -41.67 97.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 0.0 109.986 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -62.31 -41.96 98.97 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.844 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 34' ' ' ILE . 4.7 mt -63.51 -64.05 1.01 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.412 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.501 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.3 m-30 -73.61 38.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.613 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -62.72 130.68 46.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.825 0.345 . . . . 0.0 110.201 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.07 -44.3 3.11 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.72 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -86.54 54.8 3.29 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.038 0.447 . . . . 0.0 110.309 179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.455 ' OE1' ' HA ' ' A' ' 70' ' ' GLU . 4.8 mm-40 -60.73 -3.76 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.493 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.1 -50.29 73.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.909 0.385 . . . . 0.0 110.587 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.529 HD13 HG12 ' A' ' 17' ' ' ILE . 85.9 mt -68.02 -36.1 79.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.21 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.702 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.37 -37.71 65.29 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.74 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 39.0 t -56.74 -42.28 79.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.877 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.47 -41.08 76.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.619 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.9 t80 -57.0 -43.25 81.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.81 -34.05 88.86 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.948 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 74' ' ' SER . 83.8 mt-30 -49.52 -49.95 43.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.707 0.289 . . . . 0.0 111.464 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -67.47 -41.29 84.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 110.555 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 76' ' ' PHE . 66.6 mt -61.49 142.39 94.07 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.3 82.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.815 2.344 . . . . 0.0 112.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 84' ' ' LYS . 5.5 tp10 -59.45 139.3 57.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.239 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.36 -38.43 74.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.942 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.562 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -163.82 130.04 3.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.51 179.782 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.623 ' HA ' HH11 ' A' ' 85' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.947 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 19.5 p30 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.824 0.345 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.829 HG23 HD22 ' A' ' 35' ' ' LEU . 40.1 mm -61.37 -36.46 73.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.148 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -49.92 -39.3 39.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.318 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 56.7 mtm -71.14 -42.62 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.059 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.576 HD11 ' HD2' ' A' ' 13' ' ' TYR . 22.6 tp -65.33 -53.11 48.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.403 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.835 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.7 tp -57.85 -39.3 77.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 109.911 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -66.02 -36.64 83.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.744 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.44 -42.47 82.51 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.172 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.99 -45.85 78.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.995 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -59.46 -38.3 80.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.306 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.457 ' HD2' HD12 ' A' ' 11' ' ' ILE . 45.6 t80 -58.93 -54.99 40.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.306 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.86 -43.46 98.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.143 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' B' ' 9' ' ' ALA . 56.1 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.94 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.861 0.362 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.6 m -160.68 39.29 0.16 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -177.63 45.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.538 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -122.11 152.66 39.64 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.175 0.512 . . . . 0.0 111.323 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.576 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 96.0 t -61.35 -34.21 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.748 178.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 93.7 mt-10 -60.84 -36.93 80.37 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 11' ' ' ILE . 11.9 t80 -59.5 -58.31 9.16 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -65.39 -29.32 70.02 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.576 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.1 t-20 -58.06 -40.16 80.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.587 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.29 -46.12 57.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.676 179.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.558 HD13 ' CB ' ' B' ' 8' ' ' ALA . 35.0 mm -51.93 -45.52 40.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.095 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 92.9 p -56.97 -38.7 73.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.164 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.57 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 t80 -62.77 -54.8 33.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.961 0.41 . . . . 0.0 110.665 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.604 HG11 ' HA ' ' B' ' 9' ' ' ALA . 44.6 t -56.94 -39.85 68.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.99 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -58.44 -55.47 34.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.539 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 12' ' ' SER . 27.2 mtpp -53.03 -37.67 61.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.2 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' HD1' ' A' ' 21' ' ' PHE . 80.0 mt -62.02 -40.23 86.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.139 0.495 . . . . 0.0 110.231 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' B' ' 12' ' ' LEU . 41.3 ttmt -66.73 -54.0 27.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.902 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -62.91 -32.27 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.87 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HG2' HH11 ' A' ' 20' ' ' ARG . 12.2 tpp85 -69.24 -49.15 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.072 0.463 . . . . 0.0 110.924 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 27' ' ' ILE . 17.8 m-85 -92.64 40.86 1.06 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.816 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 19' ' ' THR . 38.3 mt -61.56 -35.87 79.01 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.04 -37.97 61.56 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.976 0.417 . . . . 0.0 110.482 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CG1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -115.44 74.57 4.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.065 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.29 -29.78 80.42 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.575 2.183 . . . . 0.0 111.908 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -52.03 -30.98 27.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.813 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 21' ' ' PHE . 1.6 mm -63.77 -39.55 85.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.301 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.587 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 68.2 t80 -56.44 -48.14 77.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.578 HH11 ' HA ' ' A' ' 29' ' ' ARG . 4.2 mmm180 -56.51 -57.41 12.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.799 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.511 ' O ' HG13 ' A' ' 34' ' ' ILE . 32.5 p -48.82 -48.73 41.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.467 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.7 t80 -51.7 -47.41 63.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.071 0.462 . . . . 0.0 110.637 178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 49.2 mt -58.61 -40.95 84.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.139 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 57.6 mm-40 -63.24 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.051 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.77 HD11 HD12 ' A' ' 65' ' ' LEU . 53.1 mt -62.9 -56.85 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-O 120.96 0.41 . . . . 0.0 110.244 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.709 HD22 HG23 ' B' ' 2' ' ' ILE . 72.1 mt -59.81 -37.3 78.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.55 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 5.3 m-70 -62.29 -41.62 98.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.573 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.498 HG22 ' SD ' ' A' ' 53' ' ' MET . 99.3 m -61.72 -38.54 88.27 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.194 0.521 . . . . 0.0 109.853 179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.55 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 30.5 t80 -54.47 -56.55 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.774 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.482 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 55.6 mm-40 -58.38 -42.97 88.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.126 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.55 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 28.8 mtpp -58.22 -54.91 41.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.93 -37.95 79.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.593 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.499 ' HG2' ' HG3' ' A' ' 49' ' ' PRO . 59.8 tt0 -54.68 -59.02 5.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.789 -179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -68.03 152.1 46.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.039 0.447 . . . . 0.0 111.988 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -168.52 -51.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.361 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.464 ' HB ' ' H ' ' A' ' 46' ' ' LYS . 39.5 p -156.86 -152.51 0.37 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.6 0.238 . . . . 0.0 110.516 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.464 ' H ' ' HB ' ' A' ' 45' ' ' THR . 4.1 mptp? -73.74 175.14 7.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.755 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.21 137.83 0.13 Allowed Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.448 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.7 mtm105 -61.51 130.43 91.97 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.499 ' HG3' ' HG2' ' A' ' 42' ' ' GLN . 58.7 Cg_endo -71.13 143.58 44.66 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.071 2.514 . . . . 0.0 112.611 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -172.72 53.6 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.197 0.523 . . . . 0.0 110.538 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -154.31 -40.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.587 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.73 -133.18 0.52 Allowed Glycine 0 C--N 1.313 -0.741 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.985 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.498 ' SD ' HG22 ' A' ' 37' ' ' THR . 26.1 ttt -70.91 150.85 45.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.608 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.473 ' O ' HG23 ' A' ' 58' ' ' VAL . 80.3 p -156.99 -147.93 0.2 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.025 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.551 ' OE1' HD22 ' A' ' 80' ' ' LEU . 35.4 mm-40 -70.21 -28.4 65.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.522 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 22.6 pt-20 -55.22 -49.45 71.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.787 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 37.3 tp10 -74.92 -51.52 13.57 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.528 HG13 HG22 ' A' ' 34' ' ' ILE . 46.8 t -52.73 -44.12 46.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.165 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.582 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.2 t80 -62.41 -36.01 81.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.2 m -72.07 -50.97 23.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.937 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.422 ' HA ' ' OE1' ' A' ' 61' ' ' GLU . 4.6 tp10 -58.44 -45.79 87.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.01 -179.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.565 HG23 HG21 ' A' ' 34' ' ' ILE . 94.3 t -64.45 -43.03 96.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.627 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.45 -42.18 95.62 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.15 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -59.2 -39.73 83.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.321 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.77 HD12 HD11 ' A' ' 34' ' ' ILE . 6.5 mt -68.49 -64.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.286 179.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 3.7 m-30 -74.18 41.65 0.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.65 -178.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -62.18 137.55 58.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.867 0.365 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.09 -45.01 3.25 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.323 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -88.02 52.88 2.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.064 0.459 . . . . 0.0 110.491 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.6 mt-10 -67.75 6.23 0.7 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.266 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -61.64 -48.98 78.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.174 0.511 . . . . 0.0 110.056 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.4 mt -72.32 -34.3 67.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.222 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.627 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.98 -38.16 64.73 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.993 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 41.7 t -55.11 -42.61 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.741 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.55 -45.84 78.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.592 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.582 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.7 t80 -57.54 -44.13 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.421 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.99 -41.9 98.44 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.709 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 74' ' ' SER . 73.7 mt-30 -52.57 -44.92 66.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.817 0.309 . . . . 0.0 111.646 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -64.32 -40.42 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.011 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.551 HD22 ' OE1' ' A' ' 55' ' ' GLU . 35.0 mt -65.39 130.08 94.58 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.223 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.468 ' HD2' ' HG3' ' A' ' 55' ' ' GLU . 47.9 Cg_endo -67.95 125.32 12.95 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.455 2.104 . . . . 0.0 112.116 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -92.26 44.23 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.816 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -173.73 133.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.389 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -74.91 -128.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.613 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.882 179.863 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.869 0.366 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.709 HG23 HD22 ' A' ' 35' ' ' LEU . 46.2 mm -67.64 -35.77 73.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -52.59 -35.98 55.23 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 66.1 mtt -65.15 -47.33 77.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.528 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.513 HD23 ' HB1' ' A' ' 10' ' ' ALA . 80.2 mt -69.78 -45.7 67.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.959 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.482 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 56.0 tp -57.41 -44.35 84.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -72.53 -38.48 68.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.786 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.558 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.45 -41.77 77.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.209 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.604 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.05 -43.24 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.971 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.67 -38.04 89.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.428 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.429 ' CD2' HD12 ' A' ' 11' ' ' ILE . 42.0 t80 -57.13 -55.44 34.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.472 ' HB3' ' NZ ' ' A' ' 18' ' ' LYS . 95.9 mt -64.42 -49.29 72.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.526 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.196 179.683 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 2' ' ' SER . 35.9 tp10 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.42 ' N ' ' HG3' ' A' ' 1' ' ' GLU . 80.5 p -61.57 131.25 49.48 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.715 0.293 . . . . 0.0 110.979 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.6 t70 63.19 119.04 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.997 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -66.65 142.52 57.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.121 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.555 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 99.0 t -58.44 -41.73 82.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.222 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 50.5 mt-10 -58.57 -39.48 80.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.446 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.491 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.7 t80 -58.93 -57.37 13.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.933 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.25 -31.83 73.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.9 t-20 -55.16 -41.28 71.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.658 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.755 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.84 -45.97 55.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.048 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.529 HD13 ' CB ' ' B' ' 8' ' ' ALA . 32.6 mm -52.94 -45.3 51.45 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.081 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.319 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -57.44 -36.25 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.191 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.514 ' O ' HG13 ' A' ' 17' ' ' ILE . 10.1 t80 -65.97 -53.16 42.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -59.04 -44.24 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.499 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.78 -59.9 4.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.197 0.522 . . . . 0.0 111.198 -179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.3 tttt -53.48 -38.63 63.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.711 -179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.2 mt -62.37 -40.6 88.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.965 0.412 . . . . 0.0 110.214 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -63.91 -58.27 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -58.16 -31.45 67.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.475 -179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 tpt85 -64.74 -57.59 8.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.383 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.512 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.0 m-85 -92.98 40.66 1.06 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.392 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 62.9 mt -54.59 -34.77 62.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -75.26 -39.22 60.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -105.72 78.87 0.48 Allowed Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.401 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.451 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 21.4 Cg_endo -59.26 -35.3 97.48 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.726 2.284 . . . . 0.0 112.46 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -50.8 -31.42 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.422 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.512 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.4 mm -64.27 -46.77 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 0.0 110.646 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 32' ' ' LEU . 51.4 t80 -56.76 -49.97 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.043 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.67 -53.39 58.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.719 -179.699 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.9 m -51.89 -51.7 55.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.451 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -52.06 -49.0 64.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.053 0.454 . . . . 0.0 111.119 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 80.4 mt -61.8 -42.13 98.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.7 mm-40 -61.03 -34.3 74.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.358 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.661 HG22 HG13 ' A' ' 58' ' ' VAL . 86.4 mt -61.99 -60.64 2.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.175 0.512 . . . . 0.0 110.45 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.468 HD23 HG11 ' A' ' 58' ' ' VAL . 89.8 mt -57.93 -37.97 75.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.635 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.47 -43.34 99.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.13 179.702 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.516 ' HA ' ' HZ2' ' A' ' 40' ' ' LYS . 89.2 m -56.91 -43.09 81.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.144 0.497 . . . . 0.0 110.406 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.576 ' HD2' HG21 ' B' ' 2' ' ' ILE . 42.9 t80 -65.84 -55.83 15.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.948 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.452 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 3.0 tp-100 -59.6 -48.87 79.99 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.322 -0.854 . . . . 0.0 113.056 -178.362 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.518 ' NZ ' ' HB2' ' A' ' 40' ' ' LYS . 10.4 mtmp? -52.38 -50.21 62.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.643 0.258 . . . . 0.0 111.346 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.414 ' OE1' ' HG2' ' A' ' 53' ' ' MET . 55.6 mt-10 -68.14 -36.82 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.9 0.381 . . . . 0.0 110.664 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -59.38 -39.91 84.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.913 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.5 mt -54.06 -39.87 66.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.421 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -167.51 137.56 2.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.9 p -77.18 56.58 1.31 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.785 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -126.86 120.83 30.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.0 110.883 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.78 -144.86 10.99 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.782 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 57.0 mtt85 -88.13 147.05 39.6 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.631 0.253 . . . . 0.0 111.112 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.21 144.72 46.83 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.77 2.313 . . . . 0.0 112.08 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' A' ' 53' ' ' MET . 10.7 t80 -155.04 144.84 21.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.67 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.748 HH11 ' H ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -77.08 51.53 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.412 -179.217 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.06 151.75 2.91 Favored Glycine 0 C--N 1.322 -0.229 0 CA-C-N 115.694 -0.685 . . . . 0.0 113.392 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.566 ' SD ' ' HG2' ' A' ' 57' ' ' GLU . 16.9 tpt -153.68 135.56 14.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.539 -0.33 . . . . 0.0 110.616 -179.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.505 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 78.9 p -167.41 -149.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.148 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -68.77 -33.21 73.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.406 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.5 pt-20 -56.27 -46.04 79.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.43 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.566 ' HG2' ' SD ' ' A' ' 53' ' ' MET . 34.9 tp10 -68.42 -53.25 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.661 HG13 HG22 ' A' ' 34' ' ' ILE . 37.6 t -53.25 -44.37 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.159 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.1 t80 -59.96 -37.81 80.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.326 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.7 m -72.31 -51.1 22.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.721 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -58.28 -48.17 81.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.485 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.554 HG23 HG21 ' A' ' 34' ' ' ILE . 95.4 t -64.12 -42.12 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.887 0.375 . . . . 0.0 110.237 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.811 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.13 -40.1 92.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.019 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -58.79 -40.45 84.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.457 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.533 HD11 ' CB ' ' A' ' 30' ' ' SER . 6.1 mt -68.29 -62.85 1.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.122 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HB2' HD22 ' A' ' 73' ' ' LEU . 5.1 m-30 -74.82 41.41 0.16 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.669 -179.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -64.02 133.47 53.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.718 0.294 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.34 -42.09 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.242 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -81.03 56.0 2.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 54.4 mt-10 -60.01 -4.57 0.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.073 -179.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.38 -53.82 51.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.939 0.4 . . . . 0.0 110.244 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.1 mt -71.56 -33.64 69.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.417 0.627 . . . . 0.0 109.509 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -53.85 -38.72 64.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.996 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -57.8 -42.23 83.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.929 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 59.8 mm-40 -62.71 -53.95 46.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.491 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.2 t80 -58.74 -38.97 79.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.2 0.524 . . . . 0.0 110.868 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.19 -49.46 72.06 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.396 -0.82 . . . . 0.0 114.111 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 21.4 pt20 -56.96 -37.01 70.98 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.267 0.533 . . . . 0.0 111.295 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.501 ' HD1' ' HG3' ' A' ' 78' ' ' GLN . 2.8 m-85 -58.17 -48.11 81.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.953 0.406 . . . . 0.0 110.445 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.44 HD11 ' CZ ' ' A' ' 76' ' ' PHE . 46.7 mt -75.77 144.28 76.32 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.503 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.04 136.46 73.13 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.55 2.167 . . . . 0.0 112.178 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 64.44 118.87 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.932 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -179.58 134.75 0.12 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.07 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.653 ' HD2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -173.66 141.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.153 179.681 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.412 HH11 ' HG3' ' A' ' 85' ' ' ARG . 32.5 tpt85 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.932 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.47 ' O ' ' HB ' ' B' ' 2' ' ' ILE . 15.3 p-10 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.54 0.209 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.576 HG21 ' HD2' ' A' ' 38' ' ' TYR . 32.1 mm 72.04 -37.67 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.833 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' B' ' 1' ' ' ASN . 2.6 pp0? -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.089 0.471 . . . . 0.0 109.816 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 60.2 mtm -59.12 -41.88 89.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.523 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.755 HD23 ' HB1' ' A' ' 10' ' ' ALA . 54.9 mt -71.02 -46.27 62.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.513 HD11 ' N ' ' A' ' 36' ' ' HIS . 3.3 mm? -57.5 -42.66 83.16 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.287 0.565 . . . . 0.0 109.77 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.34 -40.08 85.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.918 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.529 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.42 -46.13 83.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.584 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.425 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.5 -43.47 79.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -39.3 93.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.72 -57.73 9.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.494 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.77 -47.87 84.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.347 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.865 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.606 0.241 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.3 m 53.57 -149.01 0.43 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.185 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.32 -138.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.982 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t -64.55 153.08 40.23 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.578 0.704 . . . . 0.0 112.298 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.65 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 58.9 t -55.43 -36.42 41.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.942 178.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.7 -39.71 81.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.307 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.454 ' O ' HG12 ' A' ' 11' ' ' ILE . 12.9 t80 -60.8 -56.44 21.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.35 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.54 -34.6 78.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.65 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 5.6 t-20 -58.74 -37.0 75.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.578 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.815 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.31 -41.99 65.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.734 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.759 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.7 mm -53.75 -44.18 58.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.324 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.4 p -56.44 -36.21 68.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.01 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.1 t80 -66.9 -55.54 14.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.887 0.375 . . . . 0.0 110.841 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.0 t -60.0 -44.52 94.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.3 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -60.39 -53.88 52.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.957 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' O ' HG22 ' A' ' 19' ' ' THR . 87.7 tttt -53.72 -38.52 64.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.94 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 13' ' ' TYR . 90.0 mt -61.39 -36.59 74.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.807 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.551 ' NZ ' ' HB2' ' A' ' 18' ' ' LYS . 5.2 ttmp? -64.8 -51.87 59.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.83 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -67.43 -29.3 68.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.646 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -64.54 -62.05 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.573 ' CD2' HG13 ' A' ' 27' ' ' ILE . 49.1 m-85 -94.83 44.66 1.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.849 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -53.53 -35.99 61.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 111.063 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -75.19 -35.91 61.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.096 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.425 ' HB3' HG12 ' A' ' 27' ' ' ILE . 92.5 m-70 -106.15 78.56 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.365 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.48 -34.52 98.13 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.82 2.347 . . . . 0.0 112.417 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -51.79 -32.46 31.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.692 HG23 HD22 ' A' ' 65' ' ' LEU . 10.4 mm -64.5 -48.96 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.457 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 61.6 t80 -58.44 -50.01 75.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.995 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -59.53 -56.65 19.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.343 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.632 ' O ' HG13 ' A' ' 34' ' ' ILE . 46.8 t -44.81 -51.91 9.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.528 -179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.9 t80 -50.36 -47.11 56.24 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.085 0.469 . . . . 0.0 110.779 179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' B' ' 9' ' ' ALA . 52.0 mt -63.26 -38.9 92.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.07 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.2 tp10 -64.69 -30.26 71.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.833 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.632 HG13 ' O ' ' A' ' 30' ' ' SER . 56.3 mt -63.78 -58.21 8.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.072 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.496 HD22 HG23 ' B' ' 2' ' ' ILE . 79.1 mt -57.44 -36.25 71.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.473 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 2.2 m-70 -62.01 -48.27 81.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.4 m -54.79 -43.79 73.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.477 ' HA ' ' SD ' ' A' ' 53' ' ' MET . 5.7 t80 -50.81 -40.76 56.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -75.35 -38.67 59.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.282 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 47.6 mmtm -61.18 -56.39 21.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.68 50.79 1.38 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.647 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -145.3 -52.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 0.0 111.252 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.8 mt -83.62 37.39 0.58 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.575 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -135.86 126.59 27.3 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.3 p -138.0 133.4 33.59 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.699 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.453 ' HA ' ' HD2' ' A' ' 46' ' ' LYS . 15.9 tptm -176.68 47.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.124 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.4 -145.09 5.88 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.274 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 75.0 mtt-85 -73.78 138.24 76.8 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.584 0.231 . . . . 0.0 110.766 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.18 129.56 33.59 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.575 2.184 . . . . 0.0 112.248 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -177.82 140.45 0.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.734 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -55.44 -37.88 68.27 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.408 0.623 . . . . 0.0 111.093 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.92 -46.55 2.4 Favored Glycine 0 C--N 1.315 -0.62 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.262 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 38' ' ' TYR . 28.1 ttt -160.97 150.41 16.97 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.002 0.43 . . . . 0.0 111.438 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.495 ' O ' HG23 ' A' ' 58' ' ' VAL . 80.7 p -164.91 -142.19 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.307 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -29.59 69.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.852 0.358 . . . . 0.0 110.733 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -56.29 -49.37 74.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.12 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.468 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 41.4 tp10 -75.76 -49.49 18.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.512 HG13 HG22 ' A' ' 34' ' ' ILE . 50.5 t -52.78 -43.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.172 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 28.5 t80 -62.22 -36.14 81.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.601 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -72.84 -51.64 18.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.038 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.507 ' CD ' HG12 ' A' ' 34' ' ' ILE . 74.9 tt0 -57.8 -45.11 86.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.884 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.588 HG23 HG21 ' A' ' 34' ' ' ILE . 98.7 t -64.27 -42.74 96.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.799 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.83 -41.93 92.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.116 178.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -60.38 -39.94 89.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.232 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.692 HD22 HG23 ' A' ' 27' ' ' ILE . 1.2 mt -62.93 -64.99 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.909 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 15.1 m-30 -74.76 42.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.812 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 -59.18 129.64 43.09 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.59 -42.5 2.94 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.901 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.6 OUTLIER -81.52 50.5 1.49 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.811 0.338 . . . . 0.0 110.527 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.541 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 51.2 mt-10 -61.6 -1.15 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.47 -47.79 84.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.109 0.48 . . . . 0.0 110.422 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.0 mt -71.98 -35.39 69.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.267 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.799 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.05 -39.85 66.6 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.157 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 39.7 t -54.59 -41.06 69.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.943 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -70.2 -45.35 66.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.597 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 21.3 t80 -57.14 -45.32 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.275 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -43.2 94.3 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.865 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 74' ' ' SER . 72.9 mt-30 -56.06 -43.82 78.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.78 0.324 . . . . 0.0 111.144 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -62.11 -41.75 98.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.065 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.521 ' CD2' HD11 ' B' ' 2' ' ' ILE . 95.0 mt -64.36 136.77 96.89 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.944 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.86 47.67 2.01 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.741 2.294 . . . . 0.0 112.639 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -61.33 -44.39 97.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.22 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 65.95 143.21 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.558 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -156.64 142.95 18.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.0 0.429 . . . . 0.0 111.162 -179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.535 ' HD3' ' C ' ' A' ' 85' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.17 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.48 ' O ' ' HB ' ' B' ' 2' ' ' ILE . 43.5 p-10 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.873 0.368 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.521 HD11 ' CD2' ' A' ' 80' ' ' LEU . 24.7 mm 72.95 -39.08 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.527 0.078 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.975 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 3' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' B' ' 4' ' ' MET . 7.2 pt20 -56.77 -36.5 69.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.036 0.446 . . . . 0.0 110.233 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' MET . . . . . 0.573 ' N ' ' HG3' ' B' ' 3' ' ' GLN . 18.1 ptt? -62.82 -46.15 89.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.452 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.815 HD23 ' HB1' ' A' ' 10' ' ' ALA . 85.0 mt -68.93 -43.76 74.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.16 0.505 . . . . 0.0 110.358 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.7 tp -60.99 -44.57 97.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.612 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -73.38 -35.17 65.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.644 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.759 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.11 -39.99 66.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.214 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -59.13 -43.0 91.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.384 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.22 -50.67 72.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.946 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -59.24 -58.16 9.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.339 0.59 . . . . 0.0 111.163 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 21.9 tp -55.65 -39.17 70.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.699 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.804 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.1 m -164.02 -43.49 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.712 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -78.76 48.62 0.83 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.315 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.87 143.98 24.21 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.46 0.648 . . . . 0.0 112.143 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.628 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 56.7 t -55.6 -40.3 58.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.381 178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 52.3 mt-10 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.449 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.569 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.7 t80 -60.54 -54.71 42.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.727 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -32.59 74.31 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.49 0.662 . . . . 0.0 109.271 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.628 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 32.9 t-20 -54.46 -44.2 72.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.654 -1.157 . . . . 0.0 109.569 179.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.88 -43.72 62.19 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.066 179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.923 HG23 HD11 ' B' ' 12' ' ' LEU . 50.2 mm -51.29 -48.23 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.444 -179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.1 p -55.33 -36.5 66.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.104 -179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -62.2 -49.32 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.034 0.445 . . . . 0.0 109.942 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.462 HG11 ' HA ' ' B' ' 9' ' ' ALA . 24.4 t -66.28 -37.69 80.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.87 -44.44 89.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.335 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HA ' HG22 ' A' ' 19' ' ' THR . 53.9 tttp -66.99 -40.09 87.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.908 0.385 . . . . 0.0 110.701 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.537 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 80.1 mt -60.81 -43.06 94.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 39.1 ttpt -65.44 -54.62 25.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.88 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.607 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -60.0 -29.37 68.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.317 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 20' ' ' ARG . 13.1 tpp85 -65.43 -56.99 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.171 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.5 m-85 -94.94 43.11 1.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.079 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 19' ' ' THR . 70.3 mt -55.4 -34.97 64.84 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.844 0.355 . . . . 0.0 110.921 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -74.66 -38.68 62.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.488 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -105.77 78.16 0.45 Allowed Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.22 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.91 -30.69 93.78 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.655 2.237 . . . . 0.0 112.266 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -52.58 -34.01 48.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.586 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.5 mm -64.76 -48.47 84.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.455 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 11.1 t80 -57.95 -57.24 13.66 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.063 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.847 HH21 HD12 ' A' ' 32' ' ' LEU . 2.0 mmp_? -50.12 -54.47 20.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.311 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 34' ' ' ILE . 69.4 m -53.57 -51.42 63.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.565 -179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.53 ' HA ' HD12 ' A' ' 34' ' ' ILE . 37.5 t80 -53.21 -51.01 63.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.965 0.412 . . . . 0.0 110.916 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.847 HD12 HH21 ' A' ' 29' ' ' ARG . 38.8 mt -59.81 -37.18 78.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.103 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 5.0 mm-40 -66.18 -31.27 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.805 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 30' ' ' SER . 82.8 mt -61.61 -56.73 15.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.459 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.682 HD22 HG23 ' B' ' 2' ' ' ILE . 73.2 mt -60.25 -39.15 85.74 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.538 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 0.7 OUTLIER -61.14 -38.7 87.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.169 178.676 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.492 HG22 ' SD ' ' A' ' 53' ' ' MET . 76.1 m -62.68 -38.45 90.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.362 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.61 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 31.5 t80 -59.71 -64.09 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.408 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.53 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 34.1 mm-40 -60.02 -43.17 95.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.095 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 36' ' ' HIS . 15.4 ttmm -58.05 -45.81 86.42 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.803 0.335 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -80.19 38.39 0.41 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.408 ' HB3' ' O ' ' A' ' 39' ' ' GLN . 64.8 tt0 -124.25 -33.2 3.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.763 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.2 mt -74.26 60.98 0.85 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.269 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -148.44 37.58 0.84 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.84 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.9 p 48.79 -139.63 0.75 Allowed 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.41 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -133.25 16.44 4.1 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.8 0.333 . . . . 0.0 110.575 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.73 -42.05 62.63 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.153 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' NH1' ' HB3' ' A' ' 48' ' ' ARG . 13.2 mtp-105 -57.89 140.97 81.25 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.641 0.258 . . . . 0.0 111.04 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -66.64 134.89 36.84 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.872 2.381 . . . . 0.0 112.698 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.6 t80 64.95 142.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.294 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.428 HH11 ' HG3' ' A' ' 51' ' ' ARG . 40.5 ttt85 -65.71 -2.06 3.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.189 0.519 . . . . 0.0 111.017 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 56.17 -126.79 41.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.88 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.492 ' SD ' HG22 ' A' ' 37' ' ' THR . 25.3 ttt -72.85 143.32 47.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.245 -0.477 . . . . 0.0 110.899 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.61 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 34.6 t -161.29 -64.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.0 0.428 . . . . 0.0 111.737 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.499 ' OE1' ' HD2' ' A' ' 81' ' ' PRO . 48.7 mt-10 -144.09 -38.96 0.29 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.241 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 10.5 pt-20 -59.97 -51.33 70.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 21.8 tt0 -72.69 -41.94 64.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.319 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.578 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 46.7 t -55.46 -45.59 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.038 0.447 . . . . 0.0 110.357 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.589 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 29.0 t80 -65.75 -41.9 91.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.668 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.3 m -62.46 -48.5 79.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.936 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.712 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -59.03 -52.45 65.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.639 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.01 -45.33 94.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.394 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.793 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.4 -43.75 98.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.536 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.712 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 2.0 p30 -61.65 -38.68 88.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.84 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.503 HD22 HG23 ' A' ' 27' ' ' ILE . 1.8 mt -61.33 -63.27 1.34 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.631 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.5 m-30 -75.87 43.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.473 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.3 tpt180 -59.88 136.83 58.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.805 0.336 . . . . 0.0 110.662 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.73 -45.12 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.98 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -85.05 55.91 3.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.969 0.414 . . . . 0.0 110.407 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.13 -0.31 2.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.13 -43.73 98.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 110.733 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.31 -36.46 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.373 0.606 . . . . 0.0 110.353 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.793 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.4 OUTLIER -56.13 -36.83 68.68 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.268 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 40.3 t -53.12 -41.18 64.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.594 179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -73.01 -39.82 65.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.835 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.642 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.2 t80 -57.18 -43.18 82.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.811 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.52 -36.27 92.95 Favored Glycine 0 N--CA 1.453 -0.231 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.923 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 74' ' ' SER . 83.5 mt-30 -52.08 -47.65 65.08 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.735 0.302 . . . . 0.0 111.192 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.36 -44.52 75.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.526 HD11 ' CE2' ' A' ' 76' ' ' PHE . 85.1 mt -62.94 125.5 86.81 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.841 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.499 ' HD2' ' OE1' ' A' ' 55' ' ' GLU . 11.7 Cg_exo -69.17 119.96 6.88 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.389 2.059 . . . . 0.0 112.001 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 179.34 -48.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.819 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 56.4 -143.65 0.7 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.995 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.594 ' HB3' ' NZ ' ' A' ' 84' ' ' LYS . 5.8 ttpm? 64.33 141.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.029 0.442 . . . . 0.0 111.255 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.436 ' HG2' HH11 ' A' ' 85' ' ' ARG . 11.7 tpt180 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.863 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 22.8 p30 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.125 0.012 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.682 HG23 HD22 ' A' ' 35' ' ' LEU . 43.9 mm -53.33 -35.5 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.776 0.322 . . . . 0.0 110.736 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -54.97 -39.67 69.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 57.5 mtp -64.58 -48.37 75.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.483 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.76 HD23 ' HB1' ' A' ' 10' ' ' ALA . 83.9 mt -65.89 -45.88 80.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.961 0.41 . . . . 0.0 110.671 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.53 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 57.1 tp -59.02 -48.29 82.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -64.1 -36.2 83.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.268 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.616 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -56.4 -50.63 71.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.558 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -46.55 -44.9 18.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.214 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.14 -39.72 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.064 0.459 . . . . 0.0 110.479 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.54 ' HD2' HD12 ' B' ' 12' ' ' LEU . 74.2 t80 -60.29 -51.43 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.517 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.923 HD11 HG23 ' A' ' 11' ' ' ILE . 6.5 mp -63.13 -48.67 77.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.681 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 16.9 pt-20 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.918 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.504 0.193 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.45 ' HB2' ' HB2' ' A' ' 8' ' ' ASN . 52.8 m -63.71 134.74 55.9 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.727 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.46 -66.68 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.22 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 140.65 53.23 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.097 0.475 . . . . 0.0 111.211 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.535 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 94.7 t -65.9 -43.63 92.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.289 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 52.1 mt-10 -58.47 -39.21 79.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.55 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.607 ' O ' HG12 ' A' ' 11' ' ' ILE . 19.0 t80 -59.76 -56.33 23.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.781 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.45 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 0.9 OUTLIER -65.06 -31.71 73.06 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.564 0.697 . . . . 0.0 109.23 178.563 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.535 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.8 t-20 -55.57 -43.42 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.554 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.02 65.76 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.715 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 7' ' ' PHE . 42.0 mm -52.75 -45.21 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.127 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.7 p -57.93 -35.28 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.7 t80 -62.86 -51.91 65.18 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -62.07 -42.03 93.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.416 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -60.41 -44.72 95.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.35 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 62.3 tttp -67.79 -40.32 83.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.778 0.323 . . . . 0.0 110.607 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.4 mt -59.93 -40.96 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.306 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.24 -56.35 17.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.708 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.5 t -62.36 -29.5 70.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.85 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 tpt85 -65.91 -60.12 3.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.816 0.341 . . . . 0.0 111.309 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.8 m-85 -92.25 41.61 1.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.105 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.8 mt -53.49 -35.03 60.15 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.841 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -37.48 60.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.027 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.63 78.17 0.53 Allowed Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.271 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -58.95 -36.32 97.04 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.726 2.284 . . . . 0.0 112.528 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -50.5 -31.0 14.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.266 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 21' ' ' PHE . 10.2 mm -64.33 -48.01 87.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.133 0.492 . . . . 0.0 110.471 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.624 ' CE2' HD11 ' A' ' 32' ' ' LEU . 57.6 t80 -62.64 -48.79 77.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.133 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -54.98 -54.81 38.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.561 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.714 ' HB3' HD11 ' A' ' 65' ' ' LEU . 47.5 t -54.06 -44.11 70.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.821 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.462 ' HA ' HD12 ' A' ' 34' ' ' ILE . 60.3 t80 -55.26 -46.4 76.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.909 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.624 HD11 ' CE2' ' A' ' 28' ' ' TYR . 69.6 mt -62.81 -47.25 84.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.898 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 30' ' ' SER . 24.6 pt-20 -62.69 -24.48 67.67 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.406 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 30' ' ' SER . 93.5 mt -66.94 -57.43 10.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.408 HD22 HG23 ' B' ' 2' ' ' ILE . 91.5 mt -58.79 -40.05 82.89 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 121.525 0.679 . . . . 0.0 109.413 178.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 3.8 m-70 -61.86 -49.13 77.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.23 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.487 HG22 ' SD ' ' A' ' 53' ' ' MET . 37.1 m -52.17 -42.03 63.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.796 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.471 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 47.9 t80 -54.07 -44.07 70.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.108 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.591 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 35.8 mm-40 -73.04 -39.59 65.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.114 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 32.0 mmmt -56.47 -67.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 45' ' ' THR . 21.3 pt-20 -80.86 37.88 0.44 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.471 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 59.5 tt0 -95.43 -44.1 7.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.0 mt -52.34 -47.66 65.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.331 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.86 46.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.97 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.616 ' HA ' ' HB2' ' A' ' 41' ' ' GLU . 82.0 p 57.07 130.2 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.2 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 45' ' ' THR . 32.0 mmmt -146.93 136.75 23.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.649 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.89 -104.28 1.37 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.67 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.9 mtt-85 -51.24 139.27 25.79 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 111.591 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.552 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 34.8 Cg_endo -63.37 -154.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.009 2.473 . . . . 0.0 112.555 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.552 ' HB3' ' O ' ' A' ' 49' ' ' PRO . 10.8 t80 84.01 141.72 0.06 Allowed 'General case' 0 C--O 1.232 0.179 0 O-C-N 123.692 0.62 . . . . 0.0 110.612 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -77.9 52.97 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.507 0.67 . . . . 0.0 111.799 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.98 123.59 1.96 Allowed Glycine 0 C--N 1.316 -0.546 0 CA-C-N 114.922 -1.035 . . . . 0.0 113.67 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.747 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 11.6 ttt -87.15 144.89 26.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.204 -0.498 . . . . 0.0 110.639 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.705 ' O ' HG23 ' A' ' 58' ' ' VAL . 79.5 p -145.81 -154.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.025 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -58.53 -38.27 77.39 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.233 -179.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -57.56 -46.01 84.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.541 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.747 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 10.9 tt0 -73.64 -44.17 57.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.764 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 54' ' ' SER . 55.6 t -53.14 -47.54 55.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.766 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 30.6 t80 -63.81 -32.36 73.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.7 m -66.49 -58.3 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.942 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' OE1' HG23 ' A' ' 34' ' ' ILE . 56.0 mt-10 -57.1 -45.21 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.337 -179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.581 HG23 HG21 ' A' ' 34' ' ' ILE . 97.5 t -64.57 -42.78 96.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.628 0.251 . . . . 0.0 110.634 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.86 95.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.911 0.386 . . . . 0.0 110.3 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -58.69 -39.62 81.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.131 179.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.714 HD11 ' HB3' ' A' ' 30' ' ' SER . 3.5 mt -67.45 -59.9 3.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.66 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.448 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 4.6 m-30 -70.92 35.2 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.646 -1.161 . . . . 0.0 112.187 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 65' ' ' LEU . 38.5 ttm180 -63.1 119.86 10.34 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.08 -39.77 3.05 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.999 -179.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -83.94 53.05 2.45 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.958 0.408 . . . . 0.0 110.396 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -60.71 -7.11 2.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.019 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.657 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.7 p30 -64.08 -48.94 74.23 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.71 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 78.6 mt -72.3 -44.6 62.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.615 0.722 . . . . 0.0 109.46 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tp -52.45 -36.73 55.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.441 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.485 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 45.5 t -55.83 -44.3 77.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.582 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -66.57 -42.09 87.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.612 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 19.9 t80 -58.07 -44.95 87.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.68 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.42 -36.67 93.46 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.898 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 74' ' ' SER . 35.7 mt-30 -52.78 -47.64 67.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.624 0.249 . . . . 0.0 111.343 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.84 -45.01 83.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.833 0.349 . . . . 0.0 110.797 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.731 HD21 HD11 ' B' ' 2' ' ' ILE . 68.4 mt -66.26 133.3 94.53 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.79 123.93 10.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.248 1.965 . . . . 0.0 112.075 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -84.37 50.26 1.84 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.082 0.468 . . . . 0.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.32 -140.5 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.516 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.56 ' HB3' ' NZ ' ' A' ' 84' ' ' LYS . 6.2 ttpm? -61.1 143.72 54.91 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.138 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.907 -179.967 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ASN . . . . . 0.466 ' O ' ' HB ' ' B' ' 2' ' ' ILE . 42.9 p-10 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.686 0.279 . . . . 0.0 111.394 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ILE . . . . . 0.731 HD11 HD21 ' A' ' 80' ' ' LEU . 43.3 mm 72.97 -36.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.226 -0.146 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.208 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' GLN . . . . . 0.426 ' H ' ' C ' ' B' ' 1' ' ' ASN . 3.3 tp-100 -64.45 -46.01 84.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.175 0.512 . . . . 0.0 109.824 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.9 mtm -72.41 -41.89 65.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.975 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.481 HD11 ' HD2' ' A' ' 13' ' ' TYR . 21.8 tp -64.23 -48.24 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.591 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 36.9 tp -59.96 -45.33 93.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.088 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -63.99 -33.28 75.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.306 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.59 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.18 -44.03 83.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.578 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -46.5 75.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 34.5 t70 -60.08 -35.95 76.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.375 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 11' ' ' TYR . . . . . 0.442 ' HD2' HD12 ' A' ' 11' ' ' ILE . 61.9 t80 -65.15 -47.54 76.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.136 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.37 23.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.637 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 11' ' ' TYR . 4.2 tm-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.547 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.59 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.796 0.332 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.527 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.2 mm -54.65 -43.31 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.3 m -58.45 -36.37 73.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.872 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.5 t80 -63.72 -53.73 46.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.935 0.398 . . . . 0.0 110.684 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.7 t -61.36 -42.49 93.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.351 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -58.46 -57.46 12.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.515 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -52.99 -40.03 63.5 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.504 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.9 mt -61.9 -40.96 89.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -65.23 -55.33 19.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.273 0.558 . . . . 0.0 110.689 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.549 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -60.41 -30.88 69.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.296 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -65.95 -56.38 11.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.205 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.515 ' CD2' HG13 ' A' ' 27' ' ' ILE . 54.2 m-85 -93.29 40.16 1.06 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.14 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 19' ' ' THR . 57.5 mt -55.35 -35.03 64.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.874 0.369 . . . . 0.0 110.63 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -75.43 -39.12 59.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.735 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.56 78.53 0.45 Allowed Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.244 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -60.25 -34.72 93.64 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.712 2.275 . . . . 0.0 112.388 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -51.01 -30.41 15.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.603 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.5 mm -63.94 -45.75 96.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.03 0.443 . . . . 0.0 110.817 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.513 ' CE2' HD11 ' A' ' 32' ' ' LEU . 43.5 t80 -54.91 -48.0 73.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.868 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.597 ' NH2' HD12 ' A' ' 32' ' ' LEU . 12.5 mmp_? -54.97 -51.86 64.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.47 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.3 t -54.53 -56.76 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.996 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.78 -50.72 32.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.043 0.449 . . . . 0.0 111.163 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.597 HD12 ' NH2' ' A' ' 29' ' ' ARG . 61.5 mt -60.99 -40.06 92.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.622 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.1 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.737 HG22 HG13 ' A' ' 58' ' ' VAL . 83.1 mt -63.87 -60.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.62 HD22 HG23 ' B' ' 2' ' ' ILE . 96.6 mt -55.89 -38.47 70.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.378 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -62.79 -46.62 87.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.869 179.136 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.7 m . . . . . 0 CA--C 1.52 -0.211 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.106 179.507 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 . . . . . 0 N--CA 1.46 0.069 0 CA-C-O 120.714 0.292 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.737 HG13 HG22 ' A' ' 34' ' ' ILE . 48.6 t -52.9 -42.3 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.721 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.2 t80 -60.05 -38.86 84.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.642 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.595 HG22 HD21 ' A' ' 64' ' ' ASN . 91.2 m -70.94 -50.61 32.71 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.638 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' HG23 ' A' ' 34' ' ' ILE . 92.5 mt-10 -57.3 -47.27 81.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.239 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.483 HG23 HG21 ' A' ' 34' ' ' ILE . 98.3 t -64.55 -41.38 92.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 1.005 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.77 -40.47 92.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.164 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.595 HD21 HG22 ' A' ' 60' ' ' THR . 68.1 m-20 -60.61 -40.72 92.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.468 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mt -63.94 -63.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.333 0.587 . . . . 0.0 110.769 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.496 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.3 m-30 -75.47 42.23 0.21 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.735 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 67' ' ' ARG . 12.0 tpt180 -59.13 130.97 49.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.648 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.22 -41.93 2.08 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.188 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -82.23 53.94 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.981 0.42 . . . . 0.0 110.535 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.706 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.4 mt-10 -63.46 1.7 0.51 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.179 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -61.47 -50.05 74.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.136 0.493 . . . . 0.0 109.874 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.28 -32.69 66.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.892 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 1.005 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.17 -38.94 68.97 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.259 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 t -56.86 -40.97 77.1 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.571 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -64.2 -50.26 68.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.463 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.606 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 14.7 t80 -58.08 -42.36 85.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.728 -179.945 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.62 HG23 HD22 ' A' ' 35' ' ' LEU . 46.9 mm . . . . . 0 N--CA 1.459 -0.017 0 CA-C-O 120.807 0.337 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -55.19 -40.91 71.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -66.22 -46.82 75.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.862 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.59 HD23 ' HB1' ' A' ' 10' ' ' ALA . 70.2 mt -67.41 -48.83 66.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.848 0.356 . . . . 0.0 111.181 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.7 tp -57.11 -45.03 83.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.591 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.74 -37.38 76.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.838 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.527 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -53.04 -41.78 65.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.557 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.58 -45.39 73.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.29 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -62.58 -39.41 93.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.722 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -57.53 -55.01 40.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.411 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.62 -45.27 91.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.92 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.263 0 CA-C-O 120.96 0.41 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.638 HD13 ' CB ' ' B' ' 8' ' ' ALA . 38.1 mm -50.58 -45.42 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.964 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.571 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 48.3 t -57.74 -38.9 76.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.597 -178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.693 ' HD2' HD11 ' B' ' 5' ' ' LEU . 29.9 t80 -61.96 -52.0 65.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' B' ' 8' ' ' ALA . 26.4 t -63.05 -36.08 74.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.599 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -66.32 -47.18 74.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.531 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 12' ' ' SER . 24.9 mtpp -61.54 -41.14 96.9 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 13' ' ' TYR . 96.7 mt -59.67 -37.53 71.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.841 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -67.27 -49.85 62.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.956 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.9 t -71.28 -28.16 63.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.91 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -65.33 -59.87 3.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.955 0.407 . . . . 0.0 111.253 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.558 ' CD2' HG13 ' A' ' 27' ' ' ILE . 66.9 m-85 -93.7 41.54 1.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.774 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 19' ' ' THR . 65.6 mt -54.16 -34.99 61.78 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.631 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -75.27 -37.75 60.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.428 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -106.71 78.56 0.57 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.25 -32.95 97.06 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.729 2.286 . . . . 0.0 112.327 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.24 -34.95 34.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.917 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.6 mm -64.58 -47.75 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.548 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 13.3 t80 -61.51 -59.32 5.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.602 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 22.4 mmt85 -49.79 -53.66 23.88 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.807 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.9 p -51.9 -51.54 56.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.075 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 34' ' ' ILE . 46.0 t80 -51.25 -50.06 59.95 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.076 0.465 . . . . 0.0 110.509 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 47.7 mt -57.36 -41.7 80.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.008 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 50.4 mt-10 -64.61 -30.21 71.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.531 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 30' ' ' SER . 66.6 mt -62.44 -54.55 32.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 120.968 0.413 . . . . 0.0 109.927 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' B' ' 6' ' ' LEU . 63.2 mt -61.7 -39.16 90.5 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -59.78 -42.61 93.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.938 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.6 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.214 179.479 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.462 0.126 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.502 ' O ' HG23 ' A' ' 62' ' ' VAL . 98.4 t -52.97 -43.37 47.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.037 0.446 . . . . 0.0 110.219 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.6 t80 -62.59 -35.17 78.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.502 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.8 m -67.16 -56.53 9.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.065 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -56.87 -44.49 82.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.417 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 58' ' ' VAL . 98.0 t -64.09 -41.71 93.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.201 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.953 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.57 -43.59 97.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.103 0.478 . . . . 0.0 110.271 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -61.45 -40.2 93.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.617 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 27' ' ' ILE . 2.8 mt -62.87 -63.83 1.1 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.45 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.521 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.1 m-30 -75.28 42.25 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.66 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -61.5 133.46 55.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 0.0 110.226 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.47 -45.58 3.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.776 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.7 OUTLIER -84.15 49.78 1.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.806 0.336 . . . . 0.0 110.318 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.647 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.7 mt-10 -65.19 6.32 0.28 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.652 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.9 p30 -66.88 -45.51 77.84 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.652 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 60.3 mt -72.72 -34.98 67.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.747 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.953 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -51.45 -43.88 62.21 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.223 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -55.88 -41.04 73.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.931 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -64.35 -45.51 87.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.698 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.624 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.0 t80 -57.96 -43.8 86.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.885 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.556 -179.596 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 35' ' ' LEU . 48.5 mm . . . . . 0 CA--C 1.526 0.032 0 CA-C-O 120.772 0.32 . . . . 0.0 111.361 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . 0.407 HE21 ' HB3' ' B' ' 3' ' ' GLN . 0.0 OUTLIER -61.02 -48.64 80.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.876 -179.526 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 23.6 ptp -73.12 -40.82 64.61 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.148 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.693 HD11 ' HD2' ' A' ' 13' ' ' TYR . 26.7 tp -60.87 -50.73 72.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.032 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.5 tp -63.18 -40.81 98.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.149 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -60.6 -34.36 74.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.991 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.638 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.53 -42.29 78.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.141 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.537 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -58.11 -43.72 87.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.05 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -61.01 -42.81 99.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.499 ' HD2' HD12 ' A' ' 11' ' ' ILE . 39.8 t80 -61.28 -55.38 32.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.176 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.6 mt -60.81 -35.21 75.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.015 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.977 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.601 ' HB1' ' HA ' ' B' ' 5' ' ' LEU . . . . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.616 HD13 ' CB ' ' B' ' 8' ' ' ALA . 39.1 mm -60.77 -44.7 97.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.501 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 t -59.43 -42.29 91.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.64 ' HD2' HD11 ' B' ' 5' ' ' LEU . 12.6 t80 -59.37 -51.78 68.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.911 0.386 . . . . 0.0 110.501 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 ' HA ' ' B' ' 9' ' ' ALA . 47.7 t -57.33 -44.12 83.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -59.2 -58.27 9.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.173 0.511 . . . . 0.0 110.882 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.563 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.7 ttmt -53.45 -38.95 64.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.715 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.556 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 71.0 mt -61.77 -40.84 88.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.068 0.461 . . . . 0.0 110.149 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HZ3' HD13 ' B' ' 12' ' ' LEU . 3.4 ttmp? -65.17 -55.41 18.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.602 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.4 t -61.22 -30.29 70.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.79 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -63.75 -57.61 9.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.236 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD2' HG13 ' A' ' 27' ' ' ILE . 53.7 m-85 -95.52 43.44 1.09 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.047 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 19' ' ' THR . 66.6 mt -55.58 -35.5 65.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 110.751 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -74.77 -37.2 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.727 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -107.17 77.51 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.517 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.072 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -59.35 -33.72 97.66 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.591 2.194 . . . . 0.0 112.329 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -50.76 -32.28 19.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.044 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.524 HG13 ' CD2' ' A' ' 21' ' ' PHE . 7.8 mm -64.39 -47.8 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.706 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.564 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.2 t80 -59.8 -49.68 76.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.119 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -55.87 -53.2 59.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -52.88 -47.41 67.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.842 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HA ' HD12 ' A' ' 34' ' ' ILE . 41.9 t80 -53.7 -48.57 69.41 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.169 0.509 . . . . 0.0 110.88 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 51.9 mt -59.71 -46.76 88.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.438 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 44.2 tt0 -58.81 -30.59 67.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 30' ' ' SER . 97.2 mt -62.24 -60.45 2.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.737 ' HB2' HD13 ' B' ' 6' ' ' LEU . 58.6 mt -59.95 -35.84 75.8 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 15.3 m-70 -61.63 -42.98 99.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.943 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.1 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.167 0.508 . . . . 0.0 110.319 179.558 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 . . . . . 0 CA--C 1.527 0.075 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.516 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 65.7 t -52.83 -41.14 38.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.724 0.297 . . . . 0.0 110.848 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.47 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 21.0 t80 -61.71 -39.13 90.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.401 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 16.4 m -67.59 -50.83 56.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.882 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 57.8 mm-40 -56.88 -48.68 77.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.484 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.48 -44.99 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.81 0.338 . . . . 0.0 111.586 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.985 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.1 -44.2 97.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.506 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 1.1 p30 -62.42 -38.96 91.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.109 0.481 . . . . 0.0 110.247 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.476 HD12 HD11 ' A' ' 34' ' ' ILE . 3.0 mt -60.05 -63.1 1.42 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.191 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.5 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 9.8 m-30 -74.2 41.19 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.597 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -61.06 131.86 51.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.361 . . . . 0.0 110.531 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -45.35 3.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.562 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.484 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.61 53.88 2.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.035 0.445 . . . . 0.0 110.341 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 95.5 mt-10 -59.97 -5.54 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.023 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -60.85 -45.23 95.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 0.0 110.018 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 17' ' ' ILE . 91.4 mt -71.98 -36.11 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.985 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.985 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -53.41 -44.25 68.59 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.73 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.3 m -53.47 -41.33 66.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.815 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.93 -46.91 70.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.08 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.566 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.9 t80 -57.7 -41.76 82.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.161 0.505 . . . . 0.0 110.021 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.375 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.76 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.706 HG23 HD22 ' A' ' 35' ' ' LEU . 44.7 mm . . . . . 0 C--O 1.228 -0.074 0 CA-C-O 120.59 0.233 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -41.34 68.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.498 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 64.4 mtt -70.31 -42.54 71.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.212 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.64 HD11 ' HD2' ' A' ' 13' ' ' TYR . 19.6 tp -64.42 -49.08 72.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.824 0.345 . . . . 0.0 110.968 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.737 HD13 ' HB2' ' A' ' 35' ' ' LEU . 30.8 tp -63.45 -43.25 97.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.15 -34.45 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.158 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.616 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.15 -38.97 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.502 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.94 -45.22 74.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.002 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -63.72 -39.15 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.59 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -55.83 -54.21 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.506 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.578 HD13 ' HZ3' ' A' ' 18' ' ' LYS . 95.8 mt -63.69 -45.86 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.266 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.861 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.281 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HB1' ' B' ' 8' ' ' ALA . 41.8 mm -54.02 -42.99 57.07 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.817 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 m -54.53 -38.53 66.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.132 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 39.4 t80 -66.86 -57.46 6.96 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.931 0.396 . . . . 0.0 111.019 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' B' ' 9' ' ' ALA . 39.5 t -57.19 -43.89 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.269 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.54 -52.39 63.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.993 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -53.36 -40.08 64.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.0 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.708 HG12 HD13 ' A' ' 72' ' ' LEU . 91.9 mt -62.31 -38.19 80.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.19 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -68.97 -49.23 59.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.075 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.6 t -69.82 -27.97 65.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.654 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 20' ' ' ARG . 10.5 tpt180 -67.73 -58.45 4.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.571 ' HZ ' ' HG3' ' A' ' 69' ' ' GLN . 53.1 m-85 -90.94 38.89 0.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 72.7 mt -54.24 -34.87 61.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.044 0.449 . . . . 0.0 110.342 179.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.23 -37.22 61.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.42 78.69 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.121 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -59.04 -35.15 98.89 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.84 2.36 . . . . 0.0 112.809 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -50.84 -33.09 22.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.378 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.4 mm -64.54 -48.35 85.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.117 0.484 . . . . 0.0 111.036 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.543 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.0 t80 -59.27 -49.89 76.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.409 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -58.3 -56.17 25.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.041 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.638 ' HB2' HD11 ' A' ' 65' ' ' LEU . 60.7 m -53.44 -49.76 66.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.528 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.5 t80 -52.03 -49.68 62.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.986 0.422 . . . . 0.0 111.068 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 86.6 mt -58.66 -41.73 86.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.475 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.61 -30.25 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.121 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 30' ' ' SER . 78.1 mt -62.41 -55.1 26.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.832 HD22 HG23 ' B' ' 2' ' ' ILE . 54.2 mt -62.83 -38.62 91.51 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.449 0.643 . . . . 0.0 109.534 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -60.82 -47.23 87.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.221 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.4 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 179.374 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 . . . . . 0 C--O 1.231 0.1 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.545 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 59.6 t -53.55 -45.79 59.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.822 0.344 . . . . 0.0 110.832 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.581 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.4 t80 -60.23 -34.74 74.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.278 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.4 m -66.93 -58.81 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.048 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -56.72 -44.32 81.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.396 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.505 HG23 HG21 ' A' ' 34' ' ' ILE . 90.1 t -64.05 -42.17 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.474 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.37 -40.54 94.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.087 0.47 . . . . 0.0 110.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -61.29 -42.66 99.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.698 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.5 mt -67.13 -62.7 1.3 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.316 0.579 . . . . 0.0 110.952 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 3.3 m-30 -73.11 37.47 0.08 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.634 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' A' ' 69' ' ' GLN . 41.8 ttm180 -58.48 130.84 48.68 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.36 -31.83 2.1 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.764 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.571 ' HG3' ' HZ ' ' A' ' 21' ' ' PHE . 6.4 mm-40 -78.04 48.76 0.75 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.911 0.386 . . . . 0.0 110.492 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 4.9 mm-40 -56.08 -14.49 2.67 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.27 -49.83 75.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.639 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.708 HD13 HG12 ' A' ' 17' ' ' ILE . 88.0 mt -70.0 -34.04 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.234 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 1.3 mm? -58.51 -37.38 75.48 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.8 m -54.71 -39.26 68.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.322 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.51 -45.27 22.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.292 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.8 t80 -57.23 -43.78 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.134 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.989 -179.424 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.832 HG23 HD22 ' A' ' 35' ' ' LEU . 45.9 mm . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.703 0.287 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -54.75 -40.97 69.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.753 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 50.8 ttm -65.4 -45.38 84.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.498 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HB1' ' A' ' 10' ' ' ALA . 61.5 mt -65.66 -50.22 65.76 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.643 HD13 ' HB2' ' A' ' 35' ' ' LEU . 38.8 tp -58.02 -41.02 82.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.084 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -66.27 -37.54 85.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.287 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.747 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -59.16 -42.71 91.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.266 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.476 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.83 -46.84 81.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.119 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' B' ' 13' ' ' GLU . 8.2 t70 -57.47 -38.58 74.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.268 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' B' ' 8' ' ' ALA . 57.1 t80 -60.47 -50.66 72.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.436 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.437 HD21 ' CG2' ' A' ' 11' ' ' ILE . 86.2 mt -63.09 -49.81 73.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.804 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' B' ' 10' ' ' ASP . 16.4 pt-20 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.867 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.577 HD13 ' CB ' ' B' ' 8' ' ' ALA . 48.8 mm -51.63 -54.26 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.112 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.6 p -51.03 -33.62 26.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.781 ' HD2' HD11 ' B' ' 5' ' ' LEU . 30.9 t80 -63.2 -48.72 77.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.502 HG21 ' HB3' ' B' ' 8' ' ' ALA . 32.3 t -68.3 -40.24 82.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.742 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -62.24 -42.72 99.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.908 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.2 ttmt -66.24 -39.34 89.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.36 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 13' ' ' TYR . 85.7 mt -60.02 -40.82 84.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.175 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -64.47 -56.77 11.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.6 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.69 -29.67 70.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.008 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -68.09 -59.6 3.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.929 0.395 . . . . 0.0 111.283 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.549 ' CD2' HG13 ' A' ' 27' ' ' ILE . 60.3 m-85 -91.75 39.17 1.0 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.09 -37.24 53.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.964 0.411 . . . . 0.0 110.577 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.92 -37.46 58.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -104.16 78.61 0.34 Allowed Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.269 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -59.35 -35.42 96.69 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.87 2.38 . . . . 0.0 112.602 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -51.07 -33.12 24.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.048 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -64.44 -51.28 70.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.804 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 49.0 t80 -58.03 -47.73 82.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.629 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.419 HH11 ' HG2' ' A' ' 29' ' ' ARG . 49.7 mmt-85 -55.97 -52.22 64.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.319 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.629 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.0 m -53.69 -52.82 58.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.522 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -50.16 -51.67 41.66 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.088 0.47 . . . . 0.0 110.97 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 74.4 mt -58.17 -44.55 88.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.41 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 17.6 tp10 -62.13 -29.18 70.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.691 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.643 HG22 HG13 ' A' ' 58' ' ' VAL . 72.2 mt -64.33 -56.75 14.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.021 0.438 . . . . 0.0 109.935 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.79 HD22 HG23 ' B' ' 2' ' ' ILE . 56.9 mt -62.71 -40.08 96.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.458 0.647 . . . . 0.0 109.322 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 12.1 m-70 -59.14 -47.5 85.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 76.5 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.738 179.777 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 60' ' ' THR . 24.0 tt0 . . . . . 0 C--O 1.231 0.125 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.643 HG13 HG22 ' A' ' 34' ' ' ILE . 61.0 t -53.66 -43.46 54.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.872 0.368 . . . . 0.0 110.358 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 31.3 t80 -61.74 -33.61 74.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.197 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 45.3 m -68.0 -57.2 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.138 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.32 -43.06 83.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.513 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 58' ' ' VAL . 89.4 t -64.16 -41.35 92.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 110.119 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.784 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.63 -40.92 93.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -63.28 -37.55 87.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.936 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.546 HD22 HG23 ' A' ' 27' ' ' ILE . 5.6 mt -65.63 -65.45 0.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.494 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.708 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.3 m-30 -76.03 44.9 0.33 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.562 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -62.69 137.23 58.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.66 -43.98 2.87 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.295 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 71' ' ' ASP . 16.9 pt20 -96.16 56.45 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.757 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 57.8 mp0 -65.81 8.36 0.19 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.153 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.3 t70 -61.49 -44.64 96.72 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.25 -38.59 75.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.596 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.784 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -55.19 -39.77 69.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.946 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.7 t -56.13 -40.24 73.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.525 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -68.39 -44.45 75.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.793 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.605 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.0 t80 -56.97 -42.0 79.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.803 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.763 -179.947 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.79 HG23 HD22 ' A' ' 35' ' ' LEU . 47.4 mm . . . . . 0 CA--C 1.524 -0.042 0 CA-C-O 120.836 0.35 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -57.51 -45.37 85.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.571 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 77.4 mtp -71.89 -43.61 65.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.722 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.781 HD11 ' HD2' ' A' ' 13' ' ' TYR . 18.9 tp -61.05 -51.33 69.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.825 0.345 . . . . 0.0 110.795 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.709 HD13 ' HB2' ' A' ' 35' ' ' LEU . 29.8 tp -60.76 -38.42 85.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.098 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.85 -35.62 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.577 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.25 -39.61 66.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.317 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.66 -44.48 73.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -63.6 -39.29 94.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.928 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.429 ' HD2' HD12 ' A' ' 11' ' ' ILE . 43.1 t80 -57.85 -54.5 46.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.52 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -63.05 -47.38 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.114 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.871 179.96 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.706 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.235 0.331 0 CA-C-O 120.826 0.346 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.602 HD13 ' HB1' ' B' ' 8' ' ' ALA . 37.7 mm -52.61 -42.59 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.271 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.1 t -54.96 -38.03 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.107 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.608 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.6 t80 -67.48 -56.91 7.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.444 HG21 ' HB3' ' B' ' 8' ' ' ALA . 44.6 t -57.33 -40.43 74.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.217 0.532 . . . . 0.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.02 -54.97 21.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.053 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HA ' HG22 ' A' ' 19' ' ' THR . 63.4 tttm -53.71 -39.72 65.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.06 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.595 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 87.2 mt -62.73 -37.57 79.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.822 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -66.12 -47.93 72.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.916 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -70.74 -28.86 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.176 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.563 ' HG2' HD11 ' A' ' 72' ' ' LEU . 26.4 tpt180 -65.22 -56.7 11.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.49 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.3 m-85 -91.89 40.35 1.04 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.604 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 19' ' ' THR . 35.7 mt -56.61 -31.88 64.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.934 0.397 . . . . 0.0 110.649 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -74.71 -38.05 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.315 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.43 ' HB3' HG12 ' A' ' 27' ' ' ILE . 90.9 m-70 -106.66 78.92 0.59 Allowed Pre-proline 0 N--CA 1.447 -0.581 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.43 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 20.8 Cg_endo -58.98 -35.02 99.34 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.765 2.31 . . . . 0.0 112.604 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -53.01 -29.66 30.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.186 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.689 HG23 HD22 ' A' ' 65' ' ' LEU . 15.5 mm -64.25 -49.31 81.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.37 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.62 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.4 t80 -55.59 -50.83 69.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.847 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.43 -51.03 71.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.477 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.566 ' O ' HG13 ' A' ' 34' ' ' ILE . 48.3 t -52.31 -53.65 41.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.352 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -50.47 -50.36 52.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.254 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 29.4 mt -59.92 -40.55 89.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.4 mm-40 -64.73 -32.7 74.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.193 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 30' ' ' SER . 75.9 mt -61.47 -54.17 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 120.867 0.365 . . . . 0.0 110.367 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.673 HD22 HG23 ' B' ' 2' ' ' ILE . 77.5 mt -61.92 -42.3 98.93 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.56 -46.16 80.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.918 179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 95.8 m . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.971 179.847 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 . . . . . 0 N--CA 1.462 0.146 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.531 HG11 HD12 ' B' ' 2' ' ' ILE . 88.2 t -53.04 -44.9 52.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.171 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 18.0 t80 -61.92 -34.21 75.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.907 0.384 . . . . 0.0 110.688 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.9 m -66.06 -56.68 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.14 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HB2' HG23 ' A' ' 34' ' ' ILE . 58.7 mm-40 -58.6 -44.93 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.629 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.531 HG23 HG21 ' A' ' 34' ' ' ILE . 99.6 t -64.05 -42.47 95.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.736 0.303 . . . . 0.0 110.406 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.55 97.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.226 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -58.63 -41.72 86.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.039 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.689 HD22 HG23 ' A' ' 27' ' ' ILE . 4.8 mt -63.37 -60.18 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.555 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.567 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 5.3 m-30 -73.52 39.17 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.957 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.411 HH11 ' HG2' ' A' ' 67' ' ' ARG . 52.2 ttp85 -61.63 128.92 38.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.789 0.328 . . . . 0.0 110.42 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.19 -41.78 2.67 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.283 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -83.96 57.87 4.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.93 0.395 . . . . 0.0 110.998 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -63.65 -3.3 2.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.51 -54.98 36.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.925 0.393 . . . . 0.0 110.686 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' HG2' ' A' ' 20' ' ' ARG . 49.9 mt -68.62 -42.78 77.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.509 0.671 . . . . 0.0 109.933 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 tp -51.97 -38.14 55.57 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.206 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.3 t -55.73 -42.83 75.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.185 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 46.4 mt-10 -63.98 -45.29 89.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.292 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.608 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 16.3 t80 -57.54 -44.37 85.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.524 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.785 -179.957 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.673 HG23 HD22 ' A' ' 35' ' ' LEU . 45.5 mm . . . . . 0 CA--C 1.529 0.141 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -33.91 77.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.073 0.464 . . . . 0.0 109.779 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.3 ttm -62.62 -49.01 76.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.634 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.706 HD23 ' HB1' ' A' ' 10' ' ' ALA . 79.3 mt -68.9 -46.05 69.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.48 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 35' ' ' LEU . 45.5 tp -56.22 -39.88 73.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.07 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.62 -39.73 77.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.237 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.602 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -55.71 -39.47 71.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.112 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.62 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.24 -46.49 79.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.369 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -60.48 -39.2 86.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.669 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.83 -54.82 42.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.422 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.99 -47.08 78.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.116 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.971 -179.77 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.599 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.658 0.266 . . . . 0.0 110.438 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.76 HD13 ' HB1' ' B' ' 8' ' ' ALA . 43.5 mm -54.27 -42.04 55.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 CA-C-O 120.964 0.411 . . . . 0.0 110.299 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.1 m -56.75 -38.17 72.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.594 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 15.5 t80 -68.43 -55.31 12.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.948 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.9 -44.24 90.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.126 0.489 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -60.18 -55.39 34.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.813 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.534 ' HA ' HG22 ' A' ' 19' ' ' THR . 65.6 tttm -56.42 -40.94 75.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.883 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.3 mt -60.49 -47.77 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.904 0.383 . . . . 0.0 110.64 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 38.7 ttpt -62.85 -56.68 15.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.751 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.0 t -57.29 -29.64 64.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.179 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -70.01 -55.65 9.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.768 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.489 ' CD2' HG13 ' A' ' 27' ' ' ILE . 57.2 m-85 -91.19 38.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.904 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 67.5 mt -52.8 -34.47 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.913 0.387 . . . . 0.0 110.675 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.31 -38.99 60.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -106.27 78.25 0.5 Allowed Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.234 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.98 -34.81 94.8 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.671 2.247 . . . . 0.0 112.458 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.0 -31.26 17.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.022 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.8 mm -64.33 -47.57 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 18' ' ' LYS . 62.0 t80 -58.51 -45.77 88.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.2 mmt-85 -60.01 -56.51 20.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.611 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.579 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -51.08 -49.14 61.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.988 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.8 t80 -51.23 -50.37 59.27 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.703 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.1 mt -60.22 -39.75 87.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.681 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.51 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.227 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.744 HG22 HG13 ' A' ' 58' ' ' VAL . 85.3 mt -61.47 -56.85 15.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.119 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.773 HD22 HG23 ' B' ' 2' ' ' ILE . 65.1 mt -60.7 -38.08 83.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.233 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -62.26 -38.39 89.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.225 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 93.3 m . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.079 0.466 . . . . 0.0 110.648 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 . . . . . 0 N--CA 1.461 0.087 0 CA-C-O 120.685 0.279 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.744 HG13 HG22 ' A' ' 34' ' ' ILE . 43.2 t -53.14 -44.05 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.216 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.588 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 35.3 t80 -60.15 -37.09 79.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.588 HG22 HD21 ' A' ' 64' ' ' ASN . 87.1 m -73.29 -48.06 37.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.805 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.82 -46.6 81.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.705 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 58' ' ' VAL . 74.4 t -64.69 -42.35 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.024 179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.29 -41.05 88.05 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 109.959 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.588 HD21 HG22 ' A' ' 60' ' ' THR . 71.2 m-20 -61.36 -40.09 93.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.532 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 6.3 mt -67.27 -63.94 0.96 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.789 ' HB2' HD23 ' A' ' 73' ' ' LEU . 4.5 m-30 -74.85 42.76 0.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.793 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -62.16 137.92 58.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.01 -45.01 2.69 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.016 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.43 ' H ' ' HG2' ' A' ' 69' ' ' GLN . 4.8 pt20 -95.56 51.83 1.32 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.143 0.496 . . . . 0.0 110.277 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -66.96 7.32 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.97 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.42 -45.09 95.78 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.401 HD21 ' NZ ' ' A' ' 16' ' ' LYS . 41.9 mt -69.12 -36.15 77.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.077 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 66' ' ' PHE . 0.1 OUTLIER -54.91 -40.27 69.67 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.705 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.8 t -56.04 -40.66 73.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.474 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -66.96 -38.47 86.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.064 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.4 t80 -57.5 -45.55 84.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.779 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.276 179.783 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.773 HG23 HD22 ' A' ' 35' ' ' LEU . 46.5 mm . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.796 0.332 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -32.06 63.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.363 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.24 -45.75 91.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.086 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.599 HD23 ' HB1' ' A' ' 10' ' ' ALA . 66.1 mt -68.64 -46.21 69.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.058 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.72 -46.27 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -68.08 -37.26 81.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.552 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.76 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -58.52 -44.14 89.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.607 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.32 -43.16 96.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.395 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.14 -48.34 82.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 110.742 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -61.57 -56.58 18.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.387 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.479 HD13 ' CG2' ' A' ' 11' ' ' ILE . 22.5 tp -56.01 -48.59 75.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.752 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.928 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.584 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.912 0.387 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.495 HD13 ' CB ' ' B' ' 8' ' ' ALA . 46.7 mm -54.42 -44.93 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.096 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.9 p -58.5 -33.51 69.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.835 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.584 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 34.1 t80 -63.0 -53.26 56.8 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.455 HG11 ' HA ' ' B' ' 9' ' ' ALA . 45.3 t -63.77 -40.06 87.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.929 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.14 -45.5 93.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.136 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.2 tttt -65.57 -39.35 91.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.541 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.0 mt -60.93 -41.17 87.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.511 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -65.5 -56.18 13.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.602 179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -60.08 -29.13 68.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.472 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -66.55 -55.37 15.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.918 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.701 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 51.1 m-85 -97.2 45.73 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.022 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.27 -43.31 64.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.87 0.367 . . . . 0.0 110.933 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.08 -22.03 45.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.624 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.701 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.9 m170 -109.69 72.19 0.58 Allowed Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.482 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -66.05 -34.85 36.3 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.495 2.13 . . . . 0.0 112.379 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -52.28 -34.49 46.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.412 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.29 -45.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.127 0.489 . . . . 0.0 110.423 -179.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.401 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.1 t80 -53.44 -49.45 67.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.327 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -60.09 -54.61 43.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.759 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.588 ' OG ' HD11 ' A' ' 65' ' ' LEU . 36.1 t -51.56 -49.94 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.232 -179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.471 ' CZ ' HD11 ' A' ' 35' ' ' LEU . 36.2 t80 -53.52 -50.18 65.98 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.907 0.384 . . . . 0.0 110.94 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 96.0 mt -59.18 -37.3 77.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -62.41 -35.97 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.942 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.582 HD11 HD12 ' A' ' 65' ' ' LEU . 56.8 mt -61.69 -56.91 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.142 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.573 HD22 HG23 ' B' ' 2' ' ' ILE . 89.0 mt -57.86 -39.13 77.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.345 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.471 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -62.2 -40.05 94.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.872 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.8 m . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 121.228 0.537 . . . . 0.0 110.155 179.35 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.581 HG13 HG22 ' A' ' 34' ' ' ILE . 39.2 t -52.3 -47.38 45.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.689 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.568 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.1 t80 -59.89 -35.34 74.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.537 HG22 HD21 ' A' ' 64' ' ' ASN . 85.5 m -75.35 -52.74 10.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.021 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' OE1' ' HA ' ' A' ' 61' ' ' GLU . 4.3 tp10 -57.1 -43.96 82.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.692 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.56 HG23 HG21 ' A' ' 34' ' ' ILE . 72.9 t -64.87 -45.25 95.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.246 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -58.95 -41.08 86.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.21 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.537 HD21 HG22 ' A' ' 60' ' ' THR . 70.6 m-20 -58.99 -39.91 83.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.196 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.588 HD11 ' OG ' ' A' ' 30' ' ' SER . 4.9 mt -69.18 -61.84 1.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.578 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 66' ' ' PHE . 4.2 m-30 -73.73 38.38 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.649 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -58.59 133.76 56.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.61 -42.0 3.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.881 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.464 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.5 OUTLIER -77.91 52.3 1.04 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.871 0.367 . . . . 0.0 110.773 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -58.75 -15.26 11.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.65 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.48 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.6 p30 -60.92 -40.12 91.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.581 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 17' ' ' ILE . 97.6 mt -72.12 -40.77 67.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.001 0.429 . . . . 0.0 110.364 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.401 HD21 ' HA ' ' A' ' 63' ' ' ALA . 2.0 mm? -57.47 -33.64 68.19 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.062 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.3 t -58.14 -40.47 81.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.247 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -72.59 -44.73 61.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.522 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.584 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 11.8 t80 -57.23 -40.43 77.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.802 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.079 -179.864 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.573 HG23 HD22 ' A' ' 35' ' ' LEU . 50.3 mm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.729 0.3 . . . . 0.0 110.853 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -50.73 -37.53 42.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.604 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 59.6 mtt -58.56 -39.35 80.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.015 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.584 HD23 ' HB1' ' A' ' 10' ' ' ALA . 20.3 mt -71.7 -46.59 58.27 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.485 ' CD2' HG22 ' B' ' 2' ' ' ILE . 4.1 mm? -57.03 -42.51 80.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.518 0.675 . . . . 0.0 109.406 178.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -69.43 -36.51 76.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.856 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.495 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -61.32 -44.91 96.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.591 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.455 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.61 -41.73 73.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.876 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.87 -38.82 89.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.661 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -56.47 -54.0 50.81 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.972 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.36 -43.48 81.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.539 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.119 179.617 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.686 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.612 HD13 ' CB ' ' B' ' 8' ' ' ALA . 31.5 mm -50.91 -44.25 26.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.614 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 t -53.94 -41.61 67.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.506 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 17' ' ' ILE . 29.2 t80 -65.77 -56.61 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.829 0.347 . . . . 0.0 111.088 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.7 t -58.26 -43.49 86.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.341 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -58.07 -55.4 35.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.885 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.52 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.63 -38.97 64.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.4 mt -61.23 -43.14 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.557 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -65.03 -56.46 12.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.751 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.52 HG22 ' HA ' ' A' ' 16' ' ' LYS . 12.2 t -59.53 -31.62 69.57 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.818 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.5 tpt85 -68.78 -56.93 6.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.92 0.391 . . . . 0.0 111.359 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.479 ' CD2' HG13 ' A' ' 27' ' ' ILE . 70.9 m-85 -93.43 38.94 1.05 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.209 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 19' ' ' THR . 75.8 mt -53.94 -35.22 61.5 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 110.837 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -75.13 -38.9 60.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.888 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -106.33 79.82 0.64 Allowed Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.541 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 24.1 Cg_endo -58.84 -37.72 92.32 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.901 2.401 . . . . 0.0 112.651 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -48.58 -33.74 10.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.218 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.487 HG23 HD22 ' A' ' 65' ' ' LEU . 5.2 mm -64.43 -48.91 83.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.782 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.504 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.0 t80 -57.54 -50.84 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.87 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -56.21 -51.58 67.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.37 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.553 ' CB ' HD11 ' A' ' 65' ' ' LEU . 51.5 m -50.27 -50.5 50.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.071 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.2 t80 -53.35 -47.03 69.74 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.159 0.504 . . . . 0.0 110.611 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.3 mt -59.91 -42.69 94.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.354 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -61.55 -31.69 71.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.015 178.75 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.691 HG22 HG13 ' A' ' 58' ' ' VAL . 78.0 mt -60.63 -58.19 8.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.42 . . . . 0.0 109.935 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.844 HD22 HG23 ' B' ' 2' ' ' ILE . 89.5 mt -60.33 -38.57 84.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.3 m-70 -58.98 -40.81 85.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.707 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.9 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.075 179.301 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 N--CA 1.463 0.179 0 CA-C-O 120.639 0.257 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.691 HG13 HG22 ' A' ' 34' ' ' ILE . 61.1 t -53.35 -41.43 44.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.744 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 16.7 t80 -60.83 -39.13 87.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.586 HG22 HD21 ' A' ' 64' ' ' ASN . 85.8 m -70.94 -47.92 56.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.719 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 5.1 mm-40 -57.7 -46.96 83.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 58' ' ' VAL . 68.6 t -64.3 -41.26 91.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.911 0.386 . . . . 0.0 110.0 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.78 -39.96 93.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.105 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.586 HD21 HG22 ' A' ' 60' ' ' THR . 66.6 m-20 -60.48 -41.19 93.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.217 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CB ' ' A' ' 30' ' ' SER . 4.7 mt -66.75 -64.27 0.89 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.361 0.601 . . . . 0.0 110.669 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.451 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.6 m-30 -76.31 42.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.138 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -57.86 134.22 56.12 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.452 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.94 -41.44 2.39 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.257 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -79.52 59.95 3.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.901 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -61.51 -6.05 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.113 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.607 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.0 p30 -61.5 -44.32 97.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.424 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.607 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 98.3 mt -72.62 -40.81 66.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.168 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 63' ' ' ALA . 1.0 OUTLIER -56.31 -35.83 68.0 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.206 179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 t -58.82 -39.94 82.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.468 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -70.57 -51.36 28.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.106 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.578 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 17.9 t80 -57.53 -39.6 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.133 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 CA-C-N 115.638 -0.71 . . . . 0.0 113.385 -179.384 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.844 HG23 HD22 ' A' ' 35' ' ' LEU . 41.2 mm . . . . . 0 CA--C 1.524 -0.05 0 CA-C-O 120.79 0.329 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -54.65 -47.06 74.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.04 179.644 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 61.6 mtt -59.18 -49.5 77.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.981 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.686 HD23 ' HB1' ' A' ' 10' ' ' ALA . 87.5 mt -61.44 -48.06 82.88 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.938 0.399 . . . . 0.0 111.021 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' ' 35' ' ' LEU . 48.5 tp -61.5 -38.15 86.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 3' ' ' GLN . 4.1 tm-20 -67.18 -39.15 86.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.089 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.612 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -51.25 -43.58 61.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.786 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -57.08 -43.28 81.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -62.12 -40.61 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.644 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -59.09 -53.53 57.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.637 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.3 mt -64.62 -49.91 69.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.179 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.829 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 120.842 0.353 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.741 HD13 ' HB1' ' B' ' 8' ' ' ALA . 42.6 mm -54.8 -40.52 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.226 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.0 m -55.13 -39.66 69.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.452 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.667 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 17.0 t80 -68.73 -55.5 11.15 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.969 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.35 -37.26 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.938 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -64.03 -56.53 14.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.71 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.74 -40.12 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.504 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.667 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 79.1 mt -62.37 -45.74 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.632 ' HB2' ' HZ2' ' A' ' 18' ' ' LYS . 3.6 ttmp? -63.01 -55.87 21.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 16' ' ' LYS . 11.8 t -58.8 -32.59 69.49 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.472 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -68.31 -57.36 6.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.375 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -91.62 37.38 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.459 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 43.6 mt -56.54 -33.2 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.847 0.356 . . . . 0.0 110.729 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -74.71 -36.95 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.657 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.421 ' HB3' HG12 ' A' ' 27' ' ' ILE . 93.7 m-70 -106.37 78.9 0.56 Allowed Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.797 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.44 -37.89 95.96 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.886 2.391 . . . . 0.0 112.677 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.95 -33.43 17.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.295 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.449 HG23 HD22 ' A' ' 65' ' ' LEU . 5.5 mm -64.49 -53.5 41.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.019 0.438 . . . . 0.0 110.814 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.623 ' CE2' HD11 ' A' ' 32' ' ' LEU . 45.1 t80 -60.5 -49.44 77.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.934 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.406 HH11 ' HG2' ' A' ' 29' ' ' ARG . 50.2 mmt-85 -52.67 -52.68 54.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.182 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 34' ' ' ILE . 61.9 m -53.83 -49.32 68.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.977 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.582 ' HA ' HD12 ' A' ' 34' ' ' ILE . 62.0 t80 -51.65 -50.29 60.64 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.926 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.623 HD11 ' CE2' ' A' ' 28' ' ' TYR . 36.1 mt -57.82 -44.73 86.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.117 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 95.2 mt-10 -62.68 -30.04 71.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.763 HG22 HG13 ' A' ' 58' ' ' VAL . 76.9 mt -60.95 -56.49 17.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.944 0.402 . . . . 0.0 110.241 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.857 ' HB2' HD13 ' B' ' 6' ' ' LEU . 49.5 mt -64.53 -41.72 96.19 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.621 0.724 . . . . 0.0 109.17 178.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.526 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.8 m-70 -55.84 -41.61 74.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.954 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 70.1 m . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.384 179.478 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 tp10 . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.494 0.188 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.763 HG13 HG22 ' A' ' 34' ' ' ILE . 88.8 t -53.4 -42.56 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.061 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.611 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 23.4 t80 -63.6 -38.94 93.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.616 HG22 HD21 ' A' ' 64' ' ' ASN . 89.6 m -68.47 -48.72 63.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.838 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.448 ' OE1' HG23 ' A' ' 34' ' ' ILE . 93.0 mt-10 -57.28 -45.87 83.65 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.825 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 58' ' ' VAL . 64.8 t -64.58 -40.78 90.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.785 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.85 -39.89 90.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.039 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.616 HD21 HG22 ' A' ' 60' ' ' THR . 73.2 m-20 -64.44 -41.04 96.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.661 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.3 mt -64.04 -64.16 0.96 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.268 0.556 . . . . 0.0 111.298 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.611 ' HB2' HD23 ' A' ' 73' ' ' LEU . 6.2 m-30 -74.48 40.25 0.13 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.768 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -59.0 131.57 51.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 110.296 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.23 -43.38 2.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.966 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -86.03 52.62 2.53 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.937 0.399 . . . . 0.0 110.525 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 94.9 mt-10 -64.6 0.88 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.013 -179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -61.49 -47.98 83.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.077 0.465 . . . . 0.0 109.96 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.06 -33.64 68.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.966 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.74 -43.23 68.93 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.676 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.8 t -54.36 -40.49 68.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.696 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 49.4 mt-10 -63.35 -46.32 87.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.451 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 13.4 t80 -57.72 -44.68 86.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.54 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.047 -179.826 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.759 HG23 HD22 ' A' ' 35' ' ' LEU . 40.2 mm . . . . . 0 C--O 1.227 -0.101 0 CA-C-O 120.449 0.166 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -35.05 62.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.655 0.264 . . . . 0.0 110.61 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 95.8 mmm -69.42 -45.82 68.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.649 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' B' ' 8' ' ' ALA . 20.2 tp -64.03 -49.2 73.33 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.936 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 35' ' ' LEU . 28.5 tp -59.86 -40.39 88.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.022 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -63.88 -37.3 86.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.741 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.6 -41.5 70.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.923 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.49 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -56.87 -46.22 81.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.72 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -59.03 -38.44 79.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.176 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.411 ' C ' ' H ' ' B' ' 13' ' ' GLU . 66.6 t80 -63.42 -44.47 94.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 11' ' ' ILE . 84.6 mt -75.86 24.7 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.715 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' B' ' 11' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.183 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.124 0.488 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.591 HD13 ' HB1' ' B' ' 8' ' ' ALA . 49.4 mm -52.57 -41.89 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.92 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.0 t -58.7 -37.64 76.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.191 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.632 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -63.26 -54.15 41.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.25 0.547 . . . . 0.0 109.741 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.468 HG11 ' HA ' ' B' ' 9' ' ' ALA . 53.1 t -60.36 -38.94 79.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.85 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -63.6 -47.28 82.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.391 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.521 ' HA ' HG22 ' A' ' 19' ' ' THR . 23.5 ttmm -63.28 -36.14 82.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.592 HG12 HD13 ' A' ' 72' ' ' LEU . 81.2 mt -64.66 -42.55 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.823 0.344 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 28.7 mtpp -62.29 -46.6 88.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 110.783 179.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.522 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -71.27 -29.45 65.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.529 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -67.14 -56.02 11.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.547 ' CD2' HG13 ' A' ' 27' ' ' ILE . 73.1 m-85 -95.48 42.09 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 19' ' ' THR . 77.9 mt -54.97 -36.6 65.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.331 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -75.66 -38.47 58.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.885 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -105.86 78.15 0.45 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.198 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.45 -33.65 93.8 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.75 2.3 . . . . 0.0 112.518 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -53.51 -30.21 40.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.547 HG13 ' CD2' ' A' ' 21' ' ' PHE . 6.9 mm -64.19 -51.95 62.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.837 0.351 . . . . 0.0 111.017 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.622 ' CE2' HD11 ' A' ' 32' ' ' LEU . 62.7 t80 -57.08 -46.1 82.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.823 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.503 ' HA ' HH11 ' A' ' 29' ' ' ARG . 3.8 mmm180 -55.68 -56.11 24.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.618 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.661 ' HB2' HD11 ' A' ' 65' ' ' LEU . 50.9 m -54.64 -49.88 69.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.21 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -49.15 -47.11 45.98 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.027 0.442 . . . . 0.0 110.825 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.622 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.0 mt -60.09 -40.69 90.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.555 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -63.4 -36.81 84.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.48 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.526 HG21 HG23 ' A' ' 62' ' ' VAL . 75.3 mt -60.07 -56.32 18.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.749 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.686 HD22 HG23 ' B' ' 2' ' ' ILE . 83.4 mt -59.02 -44.41 91.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.326 0.584 . . . . 0.0 109.468 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -54.96 -42.68 72.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.708 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.52 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.393 0.14 . . . . 0.0 111.364 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.616 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.5 t -56.91 -44.14 81.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 0.0 110.375 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.7 t80 -64.24 -37.93 89.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.724 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.9 m -65.47 -55.27 18.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.11 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 59.3 mm-40 -57.54 -46.5 83.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.526 HG23 HG21 ' A' ' 34' ' ' ILE . 85.8 t -64.0 -41.35 92.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.912 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.9 -41.09 95.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.14 0.495 . . . . 0.0 109.931 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -60.08 -44.56 94.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.553 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.661 HD11 ' HB2' ' A' ' 30' ' ' SER . 3.1 mt -63.17 -61.56 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.334 0.588 . . . . 0.0 110.605 179.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.425 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 6.4 m-30 -72.94 36.94 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.486 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 65' ' ' LEU . 29.5 tpt85 -59.6 129.46 42.03 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -36.14 2.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.371 -0.918 . . . . 0.0 111.553 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -78.28 42.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.836 0.35 . . . . 0.0 110.17 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.677 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 6.3 tt0 -53.99 -11.68 0.48 Allowed 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -60.69 -49.4 77.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.87 0.367 . . . . 0.0 110.074 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 17' ' ' ILE . 82.3 mt -72.49 -34.38 67.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.541 . . . . 0.0 110.058 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.912 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -52.04 -42.32 63.02 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.107 -179.652 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 t -56.87 -41.13 77.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.257 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -67.99 -46.63 70.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.034 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.4 t80 -58.35 -41.48 84.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.357 0 CA-C-N 115.421 -0.809 . . . . 0.0 114.069 -178.99 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.686 HG23 HD22 ' A' ' 35' ' ' LEU . 51.4 mm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.605 0.24 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . 0.401 ' HB3' HE21 ' B' ' 3' ' ' GLN . 0.0 OUTLIER -57.41 -33.85 68.31 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.573 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.1 mmt -59.15 -39.44 82.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.473 HD23 ' HB1' ' A' ' 10' ' ' ALA . 35.1 mt -72.14 -45.77 59.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.8 -42.72 80.01 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.453 0.645 . . . . 0.0 109.265 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.93 -37.19 72.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.154 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.591 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -62.65 -47.19 84.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.03 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.468 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.86 -43.21 76.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.321 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.64 -38.96 89.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.715 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.47 ' HD2' HD12 ' A' ' 11' ' ' ILE . 37.1 t80 -62.23 -54.95 33.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.746 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.413 HD21 ' CG2' ' A' ' 11' ' ' ILE . 95.5 mt -62.41 -51.33 67.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.627 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.909 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.25 0 CA-C-O 120.781 0.324 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.622 HD13 ' HB1' ' B' ' 8' ' ' ALA . 40.3 mm -53.35 -45.48 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.261 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -58.29 -35.37 71.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.114 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 38.7 t80 -63.35 -55.83 21.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.195 0.521 . . . . 0.0 109.815 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' B' ' 8' ' ' ALA . 36.9 t -60.73 -38.02 77.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.453 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.57 -41.08 96.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.691 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.502 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.4 ttmt -66.77 -38.72 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.125 0.488 . . . . 0.0 110.121 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 84.8 mt -62.11 -42.83 96.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.68 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -65.28 -54.78 24.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.641 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.6 t -59.64 -31.27 69.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.569 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -68.11 -52.42 35.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.115 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.616 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 78.2 m-85 -98.3 44.17 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.026 -179.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 85.2 mt -56.39 -42.41 77.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.854 0.359 . . . . 0.0 110.546 179.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -76.21 -23.72 54.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.157 0.503 . . . . 0.0 109.86 179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.616 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.3 m170 -108.99 73.06 0.5 Allowed Pre-proline 0 CA--C 1.535 0.366 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.351 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.39 -34.59 43.2 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.639 2.226 . . . . 0.0 112.46 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -53.91 -35.25 61.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.427 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.607 ' CG1' ' HB3' ' A' ' 24' ' ' HIS . 1.0 OUTLIER -64.29 -51.65 65.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.556 -179.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 54.9 t80 -56.9 -47.24 81.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.95 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -55.61 -54.6 42.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.277 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.554 ' O ' HG13 ' A' ' 34' ' ' ILE . 44.7 t -54.16 -48.12 71.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.606 ' HA ' HD12 ' A' ' 34' ' ' ILE . 49.0 t80 -52.33 -47.52 65.98 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.99 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 66.4 mt -60.09 -41.42 92.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 39.3 tt0 -63.77 -30.02 71.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.689 HG22 HG13 ' A' ' 58' ' ' VAL . 79.6 mt -62.47 -56.71 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.124 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.052 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.749 HD22 HG23 ' B' ' 2' ' ' ILE . 78.3 mt -61.82 -36.26 80.64 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.5 0.667 . . . . 0.0 109.232 178.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 5.1 m-70 -59.95 -48.06 83.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.901 179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.5 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.239 179.121 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 . . . . . 0 N--CA 1.461 0.09 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 34' ' ' ILE . 44.6 t -52.94 -43.11 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.639 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 40.2 t80 -61.15 -36.88 80.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.875 0.369 . . . . 0.0 110.302 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.63 HG22 HD21 ' A' ' 64' ' ' ASN . 88.1 m -71.79 -48.39 46.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.475 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -56.78 -48.07 78.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.932 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.56 -41.85 93.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.068 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.663 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.7 -39.03 83.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.85 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.63 HD21 HG22 ' A' ' 60' ' ' THR . 70.3 m-20 -63.91 -37.98 89.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.347 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 30' ' ' SER . 5.8 mt -70.56 -66.28 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.512 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.561 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.0 m-30 -74.55 38.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.087 -178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -66.4 138.49 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.549 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.31 -44.53 2.79 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.527 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.523 ' C ' ' H ' ' A' ' 71' ' ' ASP . 0.7 OUTLIER -68.47 -62.95 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.82 0.343 . . . . 0.0 110.573 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.6 mt-10 59.98 -15.94 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.523 ' H ' ' C ' ' A' ' 69' ' ' GLN . 34.4 t70 -61.99 -49.17 77.15 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-O 121.096 0.474 . . . . 0.0 109.897 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.3 mt -68.84 -36.35 78.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.834 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.664 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -54.59 -39.35 67.74 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.68 179.858 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.4 t -55.44 -41.96 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.738 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.66 -42.77 77.44 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.539 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.626 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 20.1 t80 -57.28 -44.22 83.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.846 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.59 -179.969 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 35' ' ' LEU . 48.1 mm . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 120.649 0.262 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -55.4 -58.13 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.485 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -79.77 -27.99 40.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' B' ' 2' ' ' ILE . 0.9 OUTLIER -58.87 -45.95 88.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.845 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.729 HD13 ' HB2' ' A' ' 35' ' ' LEU . 43.1 tp -77.77 -44.46 27.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 tp10 -56.52 -33.16 65.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.653 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.622 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.71 -41.95 82.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.357 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.48 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.47 -47.68 78.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.442 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.98 -38.88 83.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -59.53 -54.77 42.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.849 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.87 -48.83 80.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.903 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 12.5 pt-20 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.723 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.235 0.332 0 CA-C-O 120.925 0.393 . . . . 0.0 110.278 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.506 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.4 mm -53.79 -42.76 53.7 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.416 179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 m -55.58 -37.97 68.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.823 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.553 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.9 t80 -64.84 -58.08 7.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.847 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.541 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.6 t -58.88 -45.09 91.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.396 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -61.07 -54.58 42.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.042 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.455 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.8 tttt -53.64 -37.42 63.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.197 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.607 HG12 HD13 ' A' ' 72' ' ' LEU . 95.5 mt -64.84 -37.26 79.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.002 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -65.54 -47.59 75.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.426 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.3 t -70.98 -26.99 63.39 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.754 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HG2' HD11 ' A' ' 72' ' ' LEU . 19.5 tpp180 -64.77 -58.07 7.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.318 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.794 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 61.6 m-85 -94.89 46.42 1.13 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.427 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.5 mt -55.45 -40.74 71.96 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.811 0.338 . . . . 0.0 110.796 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.38 -19.35 46.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.094 0.473 . . . . 0.0 110.156 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.794 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 58.1 m170 -110.33 74.06 0.82 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.354 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.72 -35.61 56.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.589 2.193 . . . . 0.0 112.55 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -52.17 -36.47 51.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.639 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.46 -48.35 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 110.701 -179.738 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.619 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 55.3 t80 -56.92 -51.36 69.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.118 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 29' ' ' ARG . 21.5 mmt85 -56.9 -54.29 48.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.493 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 57.0 m -52.85 -49.56 65.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.626 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.9 t80 -53.54 -49.81 66.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 110.959 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.633 HD22 ' HB2' ' B' ' 9' ' ' ALA . 41.2 mt -58.1 -39.78 79.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.161 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.59 -29.53 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.201 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.685 HD11 HD12 ' A' ' 65' ' ' LEU . 82.9 mt -61.75 -59.53 4.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.57 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.801 HD22 HG23 ' B' ' 2' ' ' ILE . 86.3 mt -60.3 -38.79 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -59.74 -42.79 93.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.242 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.3 m . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.371 179.295 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.581 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.8 t -52.63 -40.68 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.396 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.49 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 22.5 t80 -60.38 -40.22 90.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.561 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.3 m -73.59 -44.8 56.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.407 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.663 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -57.29 -47.77 80.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.232 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.66 -42.93 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.947 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -62.21 -44.81 95.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.134 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.663 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -64.12 -40.87 97.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.87 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.685 HD12 HD11 ' A' ' 34' ' ' ILE . 3.2 mt -60.98 -61.0 2.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.829 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.461 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 6.6 m-30 -72.95 38.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.826 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.2 ttm-85 -60.2 127.88 34.01 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.49 -43.23 2.78 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.802 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.43 49.84 1.88 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.94 0.4 . . . . 0.0 110.453 179.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.8 mt-10 -60.63 -8.52 2.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.732 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -61.16 -45.68 93.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.93 0.395 . . . . 0.0 109.942 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.607 HD13 HG12 ' A' ' 17' ' ' ILE . 94.4 mt -72.15 -32.63 67.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.919 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.947 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.28 -42.53 73.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.738 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 44.3 t -53.79 -39.94 65.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.234 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -68.0 -41.53 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.608 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 12.4 t80 -56.54 -43.55 79.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.246 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.26 179.553 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.801 HG23 HD22 ' A' ' 35' ' ' LEU . 37.7 mm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.857 0.361 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.64 -35.13 40.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.233 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 24.9 mmt -63.14 -50.39 70.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.591 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.723 HD23 ' HB1' ' A' ' 10' ' ' ALA . 81.9 mt -65.95 -46.91 76.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' ' 35' ' ' LEU . 41.4 tp -61.17 -47.22 87.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.27 -35.51 80.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.418 . . . . 0.0 110.184 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.541 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -52.98 -38.57 62.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.917 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.633 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -57.66 -48.27 79.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.134 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.6 -38.73 91.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.629 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -57.94 -54.24 49.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.55 -49.55 70.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.221 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.889 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.552 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.89 0.376 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.742 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.6 mm -53.15 -43.06 48.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.046 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -57.15 -38.47 73.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.028 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.592 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 25.1 t80 -63.88 -55.97 18.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.088 0.47 . . . . 0.0 110.768 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.9 t -57.1 -45.0 84.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.378 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -57.69 -56.32 23.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.111 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.2 tttt -52.99 -36.53 60.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.518 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.592 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 76.9 mt -64.19 -41.12 91.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.268 179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -64.17 -55.48 21.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.507 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.3 t -59.22 -31.18 68.81 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.396 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH2' ' HG3' ' A' ' 69' ' ' GLN . 10.8 tpt180 -68.11 -56.09 10.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.909 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 27' ' ' ILE . 55.8 m-85 -93.98 41.31 1.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.989 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.0 mt -56.96 -35.36 69.03 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.996 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -74.95 -39.95 61.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.021 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -107.74 77.24 0.61 Allowed Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.356 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.99 -33.74 95.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.593 2.195 . . . . 0.0 112.395 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -51.2 -34.11 30.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.491 HG21 ' CE2' ' A' ' 21' ' ' PHE . 3.8 mm -64.37 -45.99 94.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.167 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 59.8 t80 -58.82 -49.39 77.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -56.24 -55.49 32.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.466 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.553 ' O ' HG13 ' A' ' 34' ' ' ILE . 18.5 p -53.02 -49.01 67.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.325 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.557 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.8 t80 -51.2 -45.25 61.78 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.878 0.37 . . . . 0.0 110.435 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 64.9 mt -62.93 -49.51 74.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -53.65 -29.39 38.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.481 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.696 HG22 HG13 ' A' ' 58' ' ' VAL . 84.3 mt -61.26 -49.62 83.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.104 0.478 . . . . 0.0 110.135 179.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.762 HD22 HG23 ' B' ' 2' ' ' ILE . 58.2 mt -66.15 -40.97 90.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -38.86 84.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.21 178.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.621 178.921 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 68.5 tt0 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.595 0.236 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.696 HG13 HG22 ' A' ' 34' ' ' ILE . 66.9 t -57.96 -43.15 84.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.984 0.421 . . . . 0.0 110.513 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.635 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.3 t80 -62.86 -39.44 94.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.944 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.588 HG22 HD21 ' A' ' 64' ' ' ASN . 85.1 m -66.14 -49.67 66.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -57.33 -45.29 84.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.016 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 58' ' ' VAL . 80.7 t -64.48 -40.83 90.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.054 179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.89 -41.66 98.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.098 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.588 HD21 HG22 ' A' ' 60' ' ' THR . 74.1 m-20 -62.01 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.532 179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.604 HD12 HD11 ' A' ' 34' ' ' ILE . 5.8 mt -67.64 -65.06 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.431 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.525 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 5.9 m-30 -73.43 38.86 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.638 -179.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -58.76 132.62 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.23 -43.32 3.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.791 -178.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.8 OUTLIER -79.93 51.23 1.3 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.81 0.338 . . . . 0.0 110.587 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.1 mt-10 -61.72 -4.33 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.051 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.72 -50.61 71.75 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.964 0.411 . . . . 0.0 110.066 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.58 -36.28 73.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.981 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.92 -40.85 70.29 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.64 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.9 t -56.3 -40.35 74.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.562 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.29 -38.91 71.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.088 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.635 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.6 t80 -57.51 -43.24 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.005 0.431 . . . . 0.0 110.233 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.364 179.647 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.762 HG23 HD22 ' A' ' 35' ' ' LEU . 40.6 mm . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.721 0.296 . . . . 0.0 111.057 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -34.34 64.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.511 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 45.8 ttm -63.26 -49.92 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.256 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.552 HD23 ' HB1' ' A' ' 10' ' ' ALA . 68.6 mt -68.46 -46.72 69.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.955 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.462 HD13 ' HB2' ' A' ' 35' ' ' LEU . 63.0 tp -56.85 -44.46 82.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.556 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -68.27 -39.58 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.615 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.742 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.67 -40.49 79.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.15 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.438 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -61.9 -40.65 96.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.279 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -64.01 -44.22 93.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.793 0.33 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -64.05 -58.67 5.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.473 0.654 . . . . 0.0 110.776 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.414 HD13 HG23 ' A' ' 11' ' ' ILE . 21.2 tp -57.95 -36.97 73.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.43 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.922 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.308 0 CA-C-O 120.846 0.355 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.744 HD13 ' HB1' ' B' ' 8' ' ' ALA . 47.0 mm -51.75 -47.15 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.373 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -55.54 -36.61 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.183 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.577 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 26.5 t80 -62.46 -54.27 42.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.191 0.519 . . . . 0.0 109.68 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' B' ' 9' ' ' ALA . 61.2 t -57.75 -40.12 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.542 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.64 -53.03 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.437 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 61.3 tttp -58.14 -36.72 73.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.937 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 13' ' ' TYR . 89.1 mt -61.43 -38.47 80.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.987 0.422 . . . . 0.0 110.286 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 29.6 mtpp -64.55 -45.22 88.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.255 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.605 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -74.83 -28.66 60.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.909 -179.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.51 -56.47 15.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.974 0.416 . . . . 0.0 111.143 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.663 ' CD2' HG13 ' A' ' 27' ' ' ILE . 50.6 m-85 -97.11 48.21 1.05 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.3 mt -52.71 -40.46 63.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.692 0.282 . . . . 0.0 111.111 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -77.31 -27.32 52.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.189 0.519 . . . . 0.0 110.036 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 63.6 m170 -109.76 73.41 0.66 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.735 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -65.82 -32.71 45.62 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.311 2.007 . . . . 0.0 112.126 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -54.91 -32.09 60.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.512 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.663 HG13 ' CD2' ' A' ' 21' ' ' PHE . 2.4 mm -63.81 -48.53 85.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.958 0.409 . . . . 0.0 110.345 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.569 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.8 t80 -56.81 -48.98 76.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.532 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -56.95 -54.9 41.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.452 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.569 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.9 m -53.05 -46.43 68.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.934 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.436 ' HA ' HD12 ' A' ' 34' ' ' ILE . 43.7 t80 -52.63 -48.07 66.63 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.002 0.429 . . . . 0.0 110.699 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 48.9 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.284 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.545 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.0 mm-40 -61.68 -31.79 71.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.18 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 30' ' ' SER . 68.0 mt -62.23 -55.81 21.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.429 . . . . 0.0 109.898 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.835 ' HB2' HD13 ' B' ' 6' ' ' LEU . 43.1 mt -60.58 -39.69 88.96 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.545 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -58.07 -42.83 86.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.596 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.4 m . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.307 179.306 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.497 ' O ' ' HB ' ' A' ' 60' ' ' THR . 29.9 tt0 . . . . . 0 N--CA 1.46 0.048 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.479 ' O ' HG23 ' A' ' 62' ' ' VAL . 97.5 t -53.38 -44.78 55.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.98 0.419 . . . . 0.0 110.294 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.5 t80 -61.34 -30.75 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.271 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 58.5 m -66.76 -62.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.399 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 57' ' ' GLU . 8.8 mp0 -57.06 -41.46 78.77 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 58' ' ' VAL . 99.3 t -63.65 -44.34 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.729 0.3 . . . . 0.0 110.428 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.702 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.29 -41.67 97.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 0.0 109.986 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -62.31 -41.96 98.97 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.844 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 34' ' ' ILE . 4.7 mt -63.51 -64.05 1.01 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.412 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.501 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.3 m-30 -73.61 38.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.613 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -62.72 130.68 46.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.825 0.345 . . . . 0.0 110.201 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.07 -44.3 3.11 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.72 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.452 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.54 54.8 3.29 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.038 0.447 . . . . 0.0 110.309 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 70' ' ' GLU . 4.8 mm-40 -60.73 -3.76 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.493 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.1 -50.29 73.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.909 0.385 . . . . 0.0 110.587 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.529 HD13 HG12 ' A' ' 17' ' ' ILE . 85.9 mt -68.02 -36.1 79.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.21 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.702 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.37 -37.71 65.29 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.74 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.0 t -56.74 -42.28 79.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.47 -41.08 76.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.619 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.9 t80 -57.0 -43.25 81.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.338 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.948 -179.958 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.829 HG23 HD22 ' A' ' 35' ' ' LEU . 40.1 mm . . . . . 0 N--CA 1.458 -0.046 0 CA-C-O 120.548 0.213 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.92 -39.3 39.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.318 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 56.7 mtm -71.14 -42.62 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.059 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.576 HD11 ' HD2' ' A' ' 13' ' ' TYR . 22.6 tp -65.33 -53.11 48.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.403 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.835 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.7 tp -57.85 -39.3 77.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 109.911 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -66.02 -36.64 83.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.744 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.44 -42.47 82.51 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.172 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.99 -45.85 78.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.995 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -59.46 -38.3 80.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.306 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.457 ' HD2' HD12 ' A' ' 11' ' ' ILE . 45.6 t80 -58.93 -54.99 40.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.306 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.86 -43.46 98.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.143 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' B' ' 9' ' ' ALA . 56.1 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.94 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.824 0.345 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.558 HD13 ' CB ' ' B' ' 8' ' ' ALA . 35.0 mm -51.93 -45.52 40.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.095 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 92.9 p -56.97 -38.7 73.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.164 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.57 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 t80 -62.77 -54.8 33.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.961 0.41 . . . . 0.0 110.665 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.604 HG11 ' HA ' ' B' ' 9' ' ' ALA . 44.6 t -56.94 -39.85 68.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.99 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -58.44 -55.47 34.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.539 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 12' ' ' SER . 27.2 mtpp -53.03 -37.67 61.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.2 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' HD1' ' A' ' 21' ' ' PHE . 80.0 mt -62.02 -40.23 86.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.139 0.495 . . . . 0.0 110.231 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' B' ' 12' ' ' LEU . 41.3 ttmt -66.73 -54.0 27.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.902 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -62.91 -32.27 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.87 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HG2' HH11 ' A' ' 20' ' ' ARG . 12.2 tpp85 -69.24 -49.15 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.072 0.463 . . . . 0.0 110.924 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 27' ' ' ILE . 17.8 m-85 -92.64 40.86 1.06 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.816 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 19' ' ' THR . 38.3 mt -61.56 -35.87 79.01 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.04 -37.97 61.56 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.976 0.417 . . . . 0.0 110.482 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CG1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -115.44 74.57 4.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.065 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.29 -29.78 80.42 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.575 2.183 . . . . 0.0 111.908 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -52.03 -30.98 27.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.813 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 21' ' ' PHE . 1.6 mm -63.77 -39.55 85.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.301 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.587 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 68.2 t80 -56.44 -48.14 77.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.578 ' HA ' HH11 ' A' ' 29' ' ' ARG . 4.2 mmm180 -56.51 -57.41 12.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.799 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.511 ' O ' HG13 ' A' ' 34' ' ' ILE . 32.5 p -48.82 -48.73 41.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.467 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.7 t80 -51.7 -47.41 63.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.071 0.462 . . . . 0.0 110.637 178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 49.2 mt -58.61 -40.95 84.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.139 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 57.6 mm-40 -63.24 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.051 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.77 HD11 HD12 ' A' ' 65' ' ' LEU . 53.1 mt -62.9 -56.85 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-O 120.96 0.41 . . . . 0.0 110.244 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.709 HD22 HG23 ' B' ' 2' ' ' ILE . 72.1 mt -59.81 -37.3 78.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 5.3 m-70 -62.29 -41.62 98.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.573 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 99.3 m . . . . . 0 CA--C 1.52 -0.194 0 CA-C-O 121.194 0.521 . . . . 0.0 109.853 179.109 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 . . . . . 0 N--CA 1.462 0.132 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.528 HG13 HG22 ' A' ' 34' ' ' ILE . 46.8 t -52.73 -44.12 46.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.165 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.582 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.2 t80 -62.41 -36.01 81.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.621 HG22 HD21 ' A' ' 64' ' ' ASN . 91.2 m -72.07 -50.97 23.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.937 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.422 ' OE1' ' HA ' ' A' ' 61' ' ' GLU . 4.6 tp10 -58.44 -45.79 87.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.01 -179.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.565 HG23 HG21 ' A' ' 34' ' ' ILE . 94.3 t -64.45 -43.03 96.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.627 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.45 -42.18 95.62 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.15 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.621 HD21 HG22 ' A' ' 60' ' ' THR . 73.6 m-20 -59.2 -39.73 83.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.321 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.77 HD12 HD11 ' A' ' 34' ' ' ILE . 6.5 mt -68.49 -64.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.286 179.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 3.7 m-30 -74.18 41.65 0.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.65 -178.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -62.18 137.55 58.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.867 0.365 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.09 -45.01 3.25 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.323 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -88.02 52.88 2.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.064 0.459 . . . . 0.0 110.491 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.6 mt-10 -67.75 6.23 0.7 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.266 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -61.64 -48.98 78.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.174 0.511 . . . . 0.0 110.056 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.4 mt -72.32 -34.3 67.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.222 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.627 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.98 -38.16 64.73 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.993 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -55.11 -42.61 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.741 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.55 -45.84 78.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.592 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.582 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.7 t80 -57.54 -44.13 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.421 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.266 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.709 -179.212 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.709 HG23 HD22 ' A' ' 35' ' ' LEU . 46.2 mm . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.599 0.238 . . . . 0.0 111.443 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -35.98 55.23 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 66.1 mtt -65.15 -47.33 77.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.528 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.513 HD23 ' HB1' ' A' ' 10' ' ' ALA . 80.2 mt -69.78 -45.7 67.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.959 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 56.0 tp -57.41 -44.35 84.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -72.53 -38.48 68.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.786 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.558 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.45 -41.77 77.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.209 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.604 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.05 -43.24 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.971 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.67 -38.04 89.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.428 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.429 ' CD2' HD12 ' A' ' 11' ' ' ILE . 42.0 t80 -57.13 -55.44 34.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.472 ' HB3' ' NZ ' ' A' ' 18' ' ' LYS . 95.9 mt -64.42 -49.29 72.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.526 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.196 179.683 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.755 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.932 0.396 . . . . 0.0 111.048 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.529 HD13 ' CB ' ' B' ' 8' ' ' ALA . 32.6 mm -52.94 -45.3 51.45 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.081 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.319 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -57.44 -36.25 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.191 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.514 ' O ' HG13 ' A' ' 17' ' ' ILE . 10.1 t80 -65.97 -53.16 42.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -59.04 -44.24 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.499 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.78 -59.9 4.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.197 0.522 . . . . 0.0 111.198 -179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.3 tttt -53.48 -38.63 63.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.711 -179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.2 mt -62.37 -40.6 88.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.965 0.412 . . . . 0.0 110.214 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -63.91 -58.27 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -58.16 -31.45 67.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.475 -179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 tpt85 -64.74 -57.59 8.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.383 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.512 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.0 m-85 -92.98 40.66 1.06 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.392 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 62.9 mt -54.59 -34.77 62.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -75.26 -39.22 60.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -105.72 78.87 0.48 Allowed Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.401 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.451 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 21.4 Cg_endo -59.26 -35.3 97.48 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.726 2.284 . . . . 0.0 112.46 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -50.8 -31.42 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.422 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.512 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.4 mm -64.27 -46.77 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 0.0 110.646 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 32' ' ' LEU . 51.4 t80 -56.76 -49.97 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.043 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.67 -53.39 58.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.719 -179.699 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.9 m -51.89 -51.7 55.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.451 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -52.06 -49.0 64.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.053 0.454 . . . . 0.0 111.119 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 80.4 mt -61.8 -42.13 98.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.7 mm-40 -61.03 -34.3 74.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.358 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.661 HG22 HG13 ' A' ' 58' ' ' VAL . 86.4 mt -61.99 -60.64 2.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.175 0.512 . . . . 0.0 110.45 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.468 HD23 HG11 ' A' ' 58' ' ' VAL . 89.8 mt -57.93 -37.97 75.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.635 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.47 -43.34 99.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.13 179.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-O 121.144 0.497 . . . . 0.0 110.406 179.72 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 . . . . . 0 CA--C 1.522 -0.101 0 CA-C-O 120.723 0.296 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.661 HG13 HG22 ' A' ' 34' ' ' ILE . 37.6 t -53.25 -44.37 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.159 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.1 t80 -59.96 -37.81 80.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.326 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.525 HG22 HD21 ' A' ' 64' ' ' ASN . 92.7 m -72.31 -51.1 22.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.721 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -58.28 -48.17 81.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.485 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.554 HG23 HG21 ' A' ' 34' ' ' ILE . 95.4 t -64.12 -42.12 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.887 0.375 . . . . 0.0 110.237 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.811 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.13 -40.1 92.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.019 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.525 HD21 HG22 ' A' ' 60' ' ' THR . 64.5 m-20 -58.79 -40.45 84.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.457 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.533 HD11 ' CB ' ' A' ' 30' ' ' SER . 6.1 mt -68.29 -62.85 1.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.122 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HB2' HD22 ' A' ' 73' ' ' LEU . 5.1 m-30 -74.82 41.41 0.16 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.669 -179.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -64.02 133.47 53.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.718 0.294 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.34 -42.09 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.242 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -81.03 56.0 2.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 54.4 mt-10 -60.01 -4.57 0.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.073 -179.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.38 -53.82 51.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.939 0.4 . . . . 0.0 110.244 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.1 mt -71.56 -33.64 69.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.417 0.627 . . . . 0.0 109.509 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -53.85 -38.72 64.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.996 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -57.8 -42.23 83.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.929 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.71 -53.95 46.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.491 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.2 t80 -58.74 -38.97 79.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.2 0.524 . . . . 0.0 110.868 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.377 0 CA-C-N 115.396 -0.82 . . . . 0.0 114.111 -178.611 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 32.1 mm . . . . . 0 CA--C 1.53 0.194 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . 0.427 ' HB2' HE21 ' B' ' 3' ' ' GLN . 0.0 OUTLIER -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.089 0.471 . . . . 0.0 109.816 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 60.2 mtm -59.12 -41.88 89.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.523 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.755 HD23 ' HB1' ' A' ' 10' ' ' ALA . 54.9 mt -71.02 -46.27 62.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.513 HD11 ' N ' ' A' ' 36' ' ' HIS . 3.3 mm? -57.5 -42.66 83.16 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.287 0.565 . . . . 0.0 109.77 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.34 -40.08 85.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.918 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.529 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.42 -46.13 83.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.584 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.425 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.5 -43.47 79.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -39.3 93.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.72 -57.73 9.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.494 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.77 -47.87 84.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.347 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.865 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.815 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.909 0.385 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.759 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.7 mm -53.75 -44.18 58.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.324 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.4 p -56.44 -36.21 68.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.01 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.1 t80 -66.9 -55.54 14.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.887 0.375 . . . . 0.0 110.841 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.0 t -60.0 -44.52 94.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.3 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -60.39 -53.88 52.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.957 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.428 ' O ' HG22 ' A' ' 19' ' ' THR . 87.7 tttt -53.72 -38.52 64.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.94 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 13' ' ' TYR . 90.0 mt -61.39 -36.59 74.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.807 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.551 ' HB2' ' NZ ' ' A' ' 18' ' ' LYS . 5.2 ttmp? -64.8 -51.87 59.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.83 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -67.43 -29.3 68.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.646 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -64.54 -62.05 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.573 ' CD2' HG13 ' A' ' 27' ' ' ILE . 49.1 m-85 -94.83 44.66 1.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.849 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -53.53 -35.99 61.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 111.063 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -75.19 -35.91 61.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.096 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.425 ' HB3' HG12 ' A' ' 27' ' ' ILE . 92.5 m-70 -106.15 78.56 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.365 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.48 -34.52 98.13 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.82 2.347 . . . . 0.0 112.417 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -51.79 -32.46 31.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.692 HG23 HD22 ' A' ' 65' ' ' LEU . 10.4 mm -64.5 -48.96 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.457 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 61.6 t80 -58.44 -50.01 75.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.995 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -59.53 -56.65 19.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.343 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.632 ' O ' HG13 ' A' ' 34' ' ' ILE . 46.8 t -44.81 -51.91 9.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.528 -179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.9 t80 -50.36 -47.11 56.24 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.085 0.469 . . . . 0.0 110.779 179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' B' ' 9' ' ' ALA . 52.0 mt -63.26 -38.9 92.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.07 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.2 tp10 -64.69 -30.26 71.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.833 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.632 HG13 ' O ' ' A' ' 30' ' ' SER . 56.3 mt -63.78 -58.21 8.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.072 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.496 HD22 HG23 ' B' ' 2' ' ' ILE . 79.1 mt -57.44 -36.25 71.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 2.2 m-70 -62.01 -48.27 81.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.4 m . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 179.952 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 . . . . . 0 N--CA 1.461 0.111 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.512 HG13 HG22 ' A' ' 34' ' ' ILE . 50.5 t -52.78 -43.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.172 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 28.5 t80 -62.22 -36.14 81.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.601 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.543 HG22 HD21 ' A' ' 64' ' ' ASN . 87.7 m -72.84 -51.64 18.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.038 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.507 ' CD ' HG12 ' A' ' 34' ' ' ILE . 74.9 tt0 -57.8 -45.11 86.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.884 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.588 HG23 HG21 ' A' ' 34' ' ' ILE . 98.7 t -64.27 -42.74 96.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.799 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.83 -41.93 92.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.116 178.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.543 HD21 HG22 ' A' ' 60' ' ' THR . 71.8 m-20 -60.38 -39.94 89.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.232 179.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.692 HD22 HG23 ' A' ' 27' ' ' ILE . 1.2 mt -62.93 -64.99 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.909 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 15.1 m-30 -74.76 42.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.812 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 -59.18 129.64 43.09 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.59 -42.5 2.94 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.901 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.6 OUTLIER -81.52 50.5 1.49 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.811 0.338 . . . . 0.0 110.527 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.541 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 51.2 mt-10 -61.6 -1.15 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.47 -47.79 84.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.109 0.48 . . . . 0.0 110.422 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.0 mt -71.98 -35.39 69.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.267 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.799 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.05 -39.85 66.6 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.157 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.7 t -54.59 -41.06 69.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.943 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -70.2 -45.35 66.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.597 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 21.3 t80 -57.14 -45.32 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.275 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.175 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.865 -179.624 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.496 HG23 HD22 ' A' ' 35' ' ' LEU . 24.7 mm . . . . . 0 CA--C 1.527 0.078 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' B' ' 4' ' ' MET . 7.2 pt20 -56.77 -36.5 69.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.036 0.446 . . . . 0.0 110.233 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . 0.573 ' N ' ' HG3' ' B' ' 3' ' ' GLN . 18.1 ptt? -62.82 -46.15 89.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.452 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.815 HD23 ' HB1' ' A' ' 10' ' ' ALA . 85.0 mt -68.93 -43.76 74.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.16 0.505 . . . . 0.0 110.358 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.7 tp -60.99 -44.57 97.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.612 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -73.38 -35.17 65.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.644 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.759 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.11 -39.99 66.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.214 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -59.13 -43.0 91.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.384 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.22 -50.67 72.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.946 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -59.24 -58.16 9.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.339 0.59 . . . . 0.0 111.163 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 21.9 tp -55.65 -39.17 70.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.699 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.804 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-O 120.979 0.419 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.923 HG23 HD11 ' B' ' 12' ' ' LEU . 50.2 mm -51.29 -48.23 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.444 -179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.1 p -55.33 -36.5 66.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.104 -179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -62.2 -49.32 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.034 0.445 . . . . 0.0 109.942 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.462 HG11 ' HA ' ' B' ' 9' ' ' ALA . 24.4 t -66.28 -37.69 80.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.87 -44.44 89.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.335 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HA ' HG22 ' A' ' 19' ' ' THR . 53.9 tttp -66.99 -40.09 87.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.908 0.385 . . . . 0.0 110.701 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.537 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 80.1 mt -60.81 -43.06 94.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 39.1 ttpt -65.44 -54.62 25.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.88 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.607 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -60.0 -29.37 68.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.317 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 20' ' ' ARG . 13.1 tpp85 -65.43 -56.99 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.171 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.5 m-85 -94.94 43.11 1.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.079 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 19' ' ' THR . 70.3 mt -55.4 -34.97 64.84 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.844 0.355 . . . . 0.0 110.921 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -74.66 -38.68 62.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.488 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -105.77 78.16 0.45 Allowed Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.22 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.91 -30.69 93.78 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.655 2.237 . . . . 0.0 112.266 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -52.58 -34.01 48.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.586 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.5 mm -64.76 -48.47 84.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.455 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 11.1 t80 -57.95 -57.24 13.66 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.063 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.847 HH21 HD12 ' A' ' 32' ' ' LEU . 2.0 mmp_? -50.12 -54.47 20.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.311 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 34' ' ' ILE . 69.4 m -53.57 -51.42 63.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.565 -179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.53 ' HA ' HD12 ' A' ' 34' ' ' ILE . 37.5 t80 -53.21 -51.01 63.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.965 0.412 . . . . 0.0 110.916 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.847 HD12 HH21 ' A' ' 29' ' ' ARG . 38.8 mt -59.81 -37.18 78.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.103 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 5.0 mm-40 -66.18 -31.27 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.805 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 30' ' ' SER . 82.8 mt -61.61 -56.73 15.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.459 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.682 HD22 HG23 ' B' ' 2' ' ' ILE . 73.2 mt -60.25 -39.15 85.74 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.14 -38.7 87.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.169 178.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 76.1 m . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.362 179.263 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 21.8 tt0 . . . . . 0 N--CA 1.456 -0.175 0 CA-C-O 120.401 0.143 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.578 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 46.7 t -55.46 -45.59 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.038 0.447 . . . . 0.0 110.357 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.589 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 29.0 t80 -65.75 -41.9 91.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.668 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.3 m -62.46 -48.5 79.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.936 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.712 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -59.03 -52.45 65.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.639 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.01 -45.33 94.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.394 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.793 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.4 -43.75 98.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.536 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.712 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 2.0 p30 -61.65 -38.68 88.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.84 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.503 HD22 HG23 ' A' ' 27' ' ' ILE . 1.8 mt -61.33 -63.27 1.34 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.631 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.5 m-30 -75.87 43.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.473 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.3 tpt180 -59.88 136.83 58.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.805 0.336 . . . . 0.0 110.662 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.73 -45.12 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.98 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -85.05 55.91 3.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.969 0.414 . . . . 0.0 110.407 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.13 -0.31 2.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.13 -43.73 98.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 110.733 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.31 -36.46 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.373 0.606 . . . . 0.0 110.353 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.793 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.4 OUTLIER -56.13 -36.83 68.68 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.268 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.3 t -53.12 -41.18 64.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.594 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -73.01 -39.82 65.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.835 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.642 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.2 t80 -57.18 -43.18 82.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.811 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.231 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.923 -179.864 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.682 HG23 HD22 ' A' ' 35' ' ' LEU . 43.9 mm . . . . . 0 N--CA 1.458 -0.07 0 CA-C-O 120.776 0.322 . . . . 0.0 110.736 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -54.97 -39.67 69.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 57.5 mtp -64.58 -48.37 75.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.483 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.76 HD23 ' HB1' ' A' ' 10' ' ' ALA . 83.9 mt -65.89 -45.88 80.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.961 0.41 . . . . 0.0 110.671 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.02 -48.29 82.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -64.1 -36.2 83.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.268 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.616 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -56.4 -50.63 71.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.558 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -46.55 -44.9 18.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.214 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.14 -39.72 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.064 0.459 . . . . 0.0 110.479 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.54 ' HD2' HD12 ' B' ' 12' ' ' LEU . 74.2 t80 -60.29 -51.43 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.517 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.923 HD11 HG23 ' A' ' 11' ' ' ILE . 6.5 mp -63.13 -48.67 77.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.681 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 16.9 pt-20 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.918 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.099 0.476 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.59 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.0 mm -52.75 -45.21 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.127 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.7 p -57.93 -35.28 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.7 t80 -62.86 -51.91 65.18 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -62.07 -42.03 93.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.416 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -60.41 -44.72 95.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.35 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 62.3 tttp -67.79 -40.32 83.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.778 0.323 . . . . 0.0 110.607 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.4 mt -59.93 -40.96 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.306 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.24 -56.35 17.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.708 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.5 t -62.36 -29.5 70.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.85 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 tpt85 -65.91 -60.12 3.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.816 0.341 . . . . 0.0 111.309 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.8 m-85 -92.25 41.61 1.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.105 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.8 mt -53.49 -35.03 60.15 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.841 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -37.48 60.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.027 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.63 78.17 0.53 Allowed Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.271 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -58.95 -36.32 97.04 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.726 2.284 . . . . 0.0 112.528 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -50.5 -31.0 14.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.266 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 21' ' ' PHE . 10.2 mm -64.33 -48.01 87.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.133 0.492 . . . . 0.0 110.471 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.624 ' CE2' HD11 ' A' ' 32' ' ' LEU . 57.6 t80 -62.64 -48.79 77.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.133 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -54.98 -54.81 38.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.561 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.714 ' HB3' HD11 ' A' ' 65' ' ' LEU . 47.5 t -54.06 -44.11 70.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.821 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.462 ' HA ' HD12 ' A' ' 34' ' ' ILE . 60.3 t80 -55.26 -46.4 76.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.909 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.624 HD11 ' CE2' ' A' ' 28' ' ' TYR . 69.6 mt -62.81 -47.25 84.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.898 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 30' ' ' SER . 24.6 pt-20 -62.69 -24.48 67.67 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.406 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 30' ' ' SER . 93.5 mt -66.94 -57.43 10.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.408 HD22 HG23 ' B' ' 2' ' ' ILE . 91.5 mt -58.79 -40.05 82.89 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 121.525 0.679 . . . . 0.0 109.413 178.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 3.8 m-70 -61.86 -49.13 77.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.23 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 37.1 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.796 179.801 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.612 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 55.6 t -53.14 -47.54 55.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.766 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 30.6 t80 -63.81 -32.36 73.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.7 m -66.49 -58.3 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.942 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' OE1' HG23 ' A' ' 34' ' ' ILE . 56.0 mt-10 -57.1 -45.21 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.337 -179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.581 HG23 HG21 ' A' ' 34' ' ' ILE . 97.5 t -64.57 -42.78 96.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.628 0.251 . . . . 0.0 110.634 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.86 95.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.911 0.386 . . . . 0.0 110.3 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -58.69 -39.62 81.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.131 179.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.714 HD11 ' HB3' ' A' ' 30' ' ' SER . 3.5 mt -67.45 -59.9 3.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.66 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.448 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 4.6 m-30 -70.92 35.2 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.646 -1.161 . . . . 0.0 112.187 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 65' ' ' LEU . 38.5 ttm180 -63.1 119.86 10.34 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.08 -39.77 3.05 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.999 -179.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.486 ' H ' ' NE2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -83.94 53.05 2.45 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.958 0.408 . . . . 0.0 110.396 179.479 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -60.71 -7.11 2.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.019 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.657 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.7 p30 -64.08 -48.94 74.23 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.71 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 78.6 mt -72.3 -44.6 62.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.615 0.722 . . . . 0.0 109.46 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tp -52.45 -36.73 55.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.441 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 45.5 t -55.83 -44.3 77.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.582 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -66.57 -42.09 87.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.612 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 19.9 t80 -58.07 -44.95 87.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.68 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.898 -179.864 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' ILE . . . . . 0.408 HG23 HD22 ' A' ' 35' ' ' LEU . 43.3 mm . . . . . 0 C--O 1.226 -0.146 0 CA-C-O 120.527 0.203 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -64.45 -46.01 84.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.175 0.512 . . . . 0.0 109.824 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.9 mtm -72.41 -41.89 65.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.975 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.481 HD11 ' HD2' ' A' ' 13' ' ' TYR . 21.8 tp -64.23 -48.24 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.96 -45.33 93.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.088 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -63.99 -33.28 75.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.306 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.59 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.18 -44.03 83.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.578 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -46.5 75.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 34.5 t70 -60.08 -35.95 76.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.375 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' TYR . . . . . 0.442 ' HD2' HD12 ' A' ' 11' ' ' ILE . 61.9 t80 -65.15 -47.54 76.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.136 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.37 23.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.637 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 11' ' ' TYR . 4.2 tm-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.547 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t -59.4 -37.99 79.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.918 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -167.6 46.66 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t -54.1 160.43 1.55 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.509 0.671 . . . . 0.0 111.761 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.549 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 75.2 t -54.74 -33.97 29.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.903 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 51.5 mt-10 -58.47 -38.17 77.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.993 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.478 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.2 t80 -59.59 -58.49 8.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.408 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -64.7 -28.34 69.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.457 0.646 . . . . 0.0 109.342 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.549 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.4 t-20 -59.7 -42.36 92.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.549 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.59 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.49 -45.49 62.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.817 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.527 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.2 mm -54.65 -43.31 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.3 m -58.45 -36.37 73.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.872 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.5 t80 -63.72 -53.73 46.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.935 0.398 . . . . 0.0 110.684 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.7 t -61.36 -42.49 93.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.351 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -58.46 -57.46 12.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.818 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -52.99 -40.03 63.5 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.504 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.9 mt -61.9 -40.96 89.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -65.23 -55.33 19.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.273 0.558 . . . . 0.0 110.689 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.549 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -60.41 -30.88 69.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.296 -179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -65.95 -56.38 11.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.205 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.515 ' CD2' HG13 ' A' ' 27' ' ' ILE . 54.2 m-85 -93.29 40.16 1.06 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.14 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 19' ' ' THR . 57.5 mt -55.35 -35.03 64.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.874 0.369 . . . . 0.0 110.63 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -75.43 -39.12 59.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.735 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.56 78.53 0.45 Allowed Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.244 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -60.25 -34.72 93.64 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.712 2.275 . . . . 0.0 112.388 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -51.01 -30.41 15.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.603 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.5 mm -63.94 -45.75 96.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.03 0.443 . . . . 0.0 110.817 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.513 ' CE2' HD11 ' A' ' 32' ' ' LEU . 43.5 t80 -54.91 -48.0 73.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.868 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.597 ' NH2' HD12 ' A' ' 32' ' ' LEU . 12.5 mmp_? -54.97 -51.86 64.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.47 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' ILE . 47.3 t -54.53 -56.76 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.996 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.78 -50.72 32.76 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.043 0.449 . . . . 0.0 111.163 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.597 HD12 ' NH2' ' A' ' 29' ' ' ARG . 61.5 mt -60.99 -40.06 92.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.622 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.1 -31.43 72.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.737 HG22 HG13 ' A' ' 58' ' ' VAL . 83.1 mt -63.87 -60.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.975 0.417 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.62 HD22 HG23 ' B' ' 2' ' ' ILE . 96.6 mt -55.89 -38.47 70.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.378 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -62.79 -46.62 87.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.869 179.136 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.547 HG22 ' SD ' ' A' ' 53' ' ' MET . 94.7 m -50.98 -40.14 57.17 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.106 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.533 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 59.6 t80 -51.06 -50.61 58.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.447 178.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.428 ' HG3' HD21 ' B' ' 6' ' ' LEU . 3.9 mm100 -58.27 -42.08 85.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.26 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -57.29 -49.95 74.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.088 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.533 ' HB2' ' HB3' ' A' ' 53' ' ' MET . 67.5 mm-40 -80.36 47.71 0.95 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.251 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -142.31 -47.08 0.34 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.794 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 44' ' ' HIS . 91.0 mt -70.67 -145.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.767 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 31.4 m170 70.86 45.57 0.54 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.277 0.561 . . . . 0.0 109.923 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.5 p 51.37 -133.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.274 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -53.37 134.94 39.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.008 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -77.2 58.36 3.63 Favored Glycine 0 CA--C 1.517 0.19 0 CA-C-N 115.87 -0.604 . . . . 0.0 113.303 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 81.3 mtm180 -55.81 138.29 71.0 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.562 0.22 . . . . 0.0 110.76 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.92 131.66 33.81 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.601 2.201 . . . . 0.0 112.493 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -179.13 51.63 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.289 0.566 . . . . 0.0 110.269 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 53.61 60.05 3.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.197 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.84 -134.53 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.233 -0.894 . . . . 0.0 113.057 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.547 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.1 ttt -170.79 160.93 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.773 0.321 . . . . 0.0 111.216 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.48 ' OG ' ' HG2' ' A' ' 56' ' ' GLU . 78.7 p -158.75 -149.89 0.23 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -69.54 -36.0 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.45 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.48 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.1 pt-20 -53.8 -47.7 70.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.923 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 14.4 tp10 -65.78 -48.83 70.47 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.714 0.292 . . . . 0.0 111.287 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.737 HG13 HG22 ' A' ' 34' ' ' ILE . 48.6 t -52.9 -42.3 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.721 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.2 t80 -60.05 -38.86 84.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.642 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.595 HG22 HD21 ' A' ' 64' ' ' ASN . 91.2 m -70.94 -50.61 32.71 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.638 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' HG23 ' A' ' 34' ' ' ILE . 92.5 mt-10 -57.3 -47.27 81.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.239 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.483 HG23 HG21 ' A' ' 34' ' ' ILE . 98.3 t -64.55 -41.38 92.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 1.005 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.77 -40.47 92.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.164 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.595 HD21 HG22 ' A' ' 60' ' ' THR . 68.1 m-20 -60.61 -40.72 92.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.468 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 5.1 mt -63.94 -63.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.333 0.587 . . . . 0.0 110.769 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.496 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.3 m-30 -75.47 42.23 0.21 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.735 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 67' ' ' ARG . 12.0 tpt180 -59.13 130.97 49.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.648 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.22 -41.93 2.08 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.188 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -82.23 53.94 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.981 0.42 . . . . 0.0 110.535 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.706 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.4 mt-10 -63.46 1.7 0.51 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.179 -179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -61.47 -50.05 74.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.136 0.493 . . . . 0.0 109.874 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.6 mt -72.28 -32.69 66.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.892 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 1.005 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.17 -38.94 68.97 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.259 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.566 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 33.4 t -56.86 -40.97 77.1 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.571 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -64.2 -50.26 68.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.463 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.606 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 14.7 t80 -58.08 -42.36 85.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.23 -34.76 81.52 Favored Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.728 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 74' ' ' SER . 25.5 mt-30 -54.01 -43.48 70.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.757 0.313 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.671 ' HB3' ' HB2' ' B' ' 1' ' ' ASN . 5.7 m-85 -67.93 -47.71 67.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.517 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.429 HD21 HD11 ' B' ' 2' ' ' ILE . 44.2 mt -67.78 147.54 98.58 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.546 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -55.79 128.1 28.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.311 2.007 . . . . 0.0 112.307 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.06 132.51 48.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.99 -145.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.232 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -69.93 141.52 53.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.061 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.441 ' HD2' ' C ' ' A' ' 85' ' ' ARG . 4.1 tmm_? . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.318 -0.848 . . . . 0.0 110.5 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.671 ' HB2' ' HB3' ' A' ' 79' ' ' PHE . 20.9 p30 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.803 0.335 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.62 HG23 HD22 ' A' ' 35' ' ' LEU . 46.9 mm -63.86 -32.68 58.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.836 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -55.19 -40.91 71.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -66.22 -46.82 75.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.862 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.59 HD23 ' HB1' ' A' ' 10' ' ' ALA . 70.2 mt -67.41 -48.83 66.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.848 0.356 . . . . 0.0 111.181 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.428 HD21 ' HG3' ' A' ' 39' ' ' GLN . 67.7 tp -57.11 -45.03 83.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.591 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.74 -37.38 76.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.838 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.527 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -53.04 -41.78 65.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.557 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.58 -45.39 73.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.29 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -62.58 -39.41 93.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.722 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -57.53 -55.01 40.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.411 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.62 -45.27 91.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.92 180.0 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -161.93 -52.2 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.687 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -73.76 76.74 1.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.858 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 t -50.96 148.74 3.99 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.555 0.693 . . . . 0.0 111.852 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.597 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 74.9 t -55.44 -39.11 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.057 178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 92.4 mt-10 -59.8 -36.8 77.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.143 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -61.65 -59.53 5.05 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 -62.98 -29.34 70.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.446 0.641 . . . . 0.0 109.314 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.597 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.0 t-20 -57.18 -43.69 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.543 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.79 -43.94 71.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.525 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.638 HD13 ' CB ' ' B' ' 8' ' ' ALA . 38.1 mm -50.58 -45.42 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.964 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.571 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 48.3 t -57.74 -38.9 76.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.597 -178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.693 ' HD2' HD11 ' B' ' 5' ' ' LEU . 29.9 t80 -61.96 -52.0 65.81 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.964 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' B' ' 8' ' ' ALA . 26.4 t -63.05 -36.08 74.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.599 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -66.32 -47.18 74.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.531 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 12' ' ' SER . 24.9 mtpp -61.54 -41.14 96.9 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 13' ' ' TYR . 96.7 mt -59.67 -37.53 71.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.841 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -67.27 -49.85 62.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.956 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.9 t -71.28 -28.16 63.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.91 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -65.33 -59.87 3.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.955 0.407 . . . . 0.0 111.253 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.558 ' CD2' HG13 ' A' ' 27' ' ' ILE . 66.9 m-85 -93.7 41.54 1.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.774 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 19' ' ' THR . 65.6 mt -54.16 -34.99 61.78 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.631 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -75.27 -37.75 60.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.428 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -106.71 78.56 0.57 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.25 -32.95 97.06 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.729 2.286 . . . . 0.0 112.327 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.24 -34.95 34.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.917 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.6 mm -64.58 -47.75 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.912 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.548 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 13.3 t80 -61.51 -59.32 5.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.602 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 22.4 mmt85 -49.79 -53.66 23.88 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.807 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 34' ' ' ILE . 51.9 p -51.9 -51.54 56.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.075 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 34' ' ' ILE . 46.0 t80 -51.25 -50.06 59.95 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.076 0.465 . . . . 0.0 110.509 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 47.7 mt -57.36 -41.7 80.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.008 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 50.4 mt-10 -64.61 -30.21 71.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.531 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 30' ' ' SER . 66.6 mt -62.44 -54.55 32.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 120.968 0.413 . . . . 0.0 109.927 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' B' ' 6' ' ' LEU . 63.2 mt -61.7 -39.16 90.5 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -59.78 -42.61 93.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.938 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.405 HG22 ' SD ' ' A' ' 53' ' ' MET . 83.6 m -62.6 -39.16 92.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.214 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.496 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 42.4 t80 -54.12 -57.73 9.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.801 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.473 ' HG3' HD23 ' B' ' 6' ' ' LEU . 13.1 mm100 -61.0 -41.86 97.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 68.4 mttm -58.28 -46.7 85.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.703 0.287 . . . . 0.0 111.443 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 37' ' ' THR . 66.5 mm-40 -66.6 -47.01 74.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.468 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -60.34 -48.83 80.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.404 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.514 ' O ' ' HB2' ' A' ' 44' ' ' HIS . 95.6 mt -62.34 135.24 57.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.081 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.514 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 34.9 m170 81.41 120.96 0.05 OUTLIER 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 71.2 p -66.48 -140.68 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.575 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? 56.63 61.75 2.54 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.849 0.356 . . . . 0.0 110.939 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -159.87 141.74 7.71 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.487 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.5 ' HB2' ' HB2' ' A' ' 51' ' ' ARG . 98.6 mtt180 -52.68 137.97 42.72 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-O 120.644 0.259 . . . . 0.0 111.028 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.95 124.79 12.25 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.503 2.135 . . . . 0.0 112.237 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.7 t80 52.18 46.6 26.34 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.401 0.62 . . . . 0.0 110.591 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 36.5 mmt180 -147.99 59.29 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.847 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -158.6 -106.91 0.23 Allowed Glycine 0 CA--C 1.508 -0.352 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.862 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.405 ' HG3' ' OE1' ' A' ' 57' ' ' GLU . 27.3 ttt -137.93 144.34 41.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.991 0.424 . . . . 0.0 111.413 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 58' ' ' VAL . 79.1 p -161.1 -154.59 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.366 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -60.74 -33.22 72.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.703 0.287 . . . . 0.0 111.309 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.4 pt-20 -62.03 -50.75 70.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.435 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 29.7 tt0 -73.21 -44.2 60.04 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 54' ' ' SER . 98.4 t -52.97 -43.37 47.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.037 0.446 . . . . 0.0 110.219 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.579 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 19.6 t80 -62.59 -35.17 78.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.502 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.8 m -67.16 -56.53 9.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.065 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -56.87 -44.49 82.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.417 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 58' ' ' VAL . 98.0 t -64.09 -41.71 93.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.201 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.953 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.57 -43.59 97.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.103 0.478 . . . . 0.0 110.271 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -61.45 -40.2 93.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.617 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 27' ' ' ILE . 2.8 mt -62.87 -63.83 1.1 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.45 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.521 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.1 m-30 -75.28 42.25 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.66 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -61.5 133.46 55.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 0.0 110.226 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.47 -45.58 3.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.776 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.7 OUTLIER -84.15 49.78 1.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.806 0.336 . . . . 0.0 110.318 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.647 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.7 mt-10 -65.19 6.32 0.28 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.652 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.9 p30 -66.88 -45.51 77.84 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.652 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 60.3 mt -72.72 -34.98 67.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.747 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.953 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -51.45 -43.88 62.21 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.223 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 35.2 t -55.88 -41.04 73.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.931 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -64.35 -45.51 87.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.698 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.624 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.0 t80 -57.96 -43.8 86.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.885 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.54 -23.47 73.7 Favored Glycine 0 CA--C 1.519 0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.556 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 74' ' ' SER . 12.6 mm100 -44.53 -53.97 6.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.901 0.35 . . . . 0.0 111.69 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -76.37 -38.71 55.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.886 0.374 . . . . 0.0 110.572 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.488 HD21 HD11 ' B' ' 2' ' ' ILE . 61.4 mt -60.81 151.67 72.04 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.879 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.57 138.73 81.5 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.604 2.203 . . . . 0.0 112.276 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -57.65 -40.4 79.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.334 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.66 143.89 23.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.512 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.5 tttm -163.02 -60.56 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.001 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.028 -179.84 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 5.0 m120 . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.534 0.207 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.776 HG23 HD22 ' A' ' 35' ' ' LEU . 48.5 mm -63.59 -30.84 50.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.772 0.32 . . . . 0.0 111.361 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . 0.407 HE21 ' HB3' ' B' ' 3' ' ' GLN . 0.0 OUTLIER -61.02 -48.64 80.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.876 -179.526 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 23.6 ptp -73.12 -40.82 64.61 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.148 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.693 HD11 ' HD2' ' A' ' 13' ' ' TYR . 26.7 tp -60.87 -50.73 72.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.032 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.5 tp -63.18 -40.81 98.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.149 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -60.6 -34.36 74.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.991 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.638 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.53 -42.29 78.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.141 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.537 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -58.11 -43.72 87.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.05 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -61.01 -42.81 99.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.499 ' HD2' HD12 ' A' ' 11' ' ' ILE . 39.8 t80 -61.28 -55.38 32.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.176 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.6 mt -60.81 -35.21 75.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.015 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.977 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.532 0.205 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 t -58.37 -50.55 73.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 111.076 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -66.95 127.85 34.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.681 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 p -62.08 143.21 56.95 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.536 0.684 . . . . 0.0 112.462 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -56.04 -41.51 68.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.111 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.32 -35.15 59.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.136 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.507 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.9 t80 -65.06 -64.8 0.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.4 m-80 -59.32 -43.84 92.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.13 0.491 . . . . 0.0 110.187 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -55.04 -41.52 71.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.667 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.601 ' HB1' ' HA ' ' B' ' 5' ' ' LEU . . . -63.49 -39.77 95.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.937 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.616 HD13 ' CB ' ' B' ' 8' ' ' ALA . 39.1 mm -60.77 -44.7 97.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.501 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 t -59.43 -42.29 91.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.64 ' HD2' HD11 ' B' ' 5' ' ' LEU . 12.6 t80 -59.37 -51.78 68.45 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.911 0.386 . . . . 0.0 110.501 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 ' HA ' ' B' ' 9' ' ' ALA . 47.7 t -57.33 -44.12 83.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -59.2 -58.27 9.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.173 0.511 . . . . 0.0 110.882 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.563 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.7 ttmt -53.45 -38.95 64.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.715 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.556 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 71.0 mt -61.77 -40.84 88.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.068 0.461 . . . . 0.0 110.149 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HZ3' HD13 ' B' ' 12' ' ' LEU . 3.4 ttmp? -65.17 -55.41 18.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.602 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.4 t -61.22 -30.29 70.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.79 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -63.75 -57.61 9.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.236 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD2' HG13 ' A' ' 27' ' ' ILE . 53.7 m-85 -95.52 43.44 1.09 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.047 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 19' ' ' THR . 66.6 mt -55.58 -35.5 65.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 110.751 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -74.77 -37.2 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.727 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -107.17 77.51 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.517 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.072 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -59.35 -33.72 97.66 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.591 2.194 . . . . 0.0 112.329 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -50.76 -32.28 19.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.044 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.524 HG13 ' CD2' ' A' ' 21' ' ' PHE . 7.8 mm -64.39 -47.8 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.706 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.564 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.2 t80 -59.8 -49.68 76.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.119 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -55.87 -53.2 59.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -52.88 -47.41 67.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.842 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' HA ' HD12 ' A' ' 34' ' ' ILE . 41.9 t80 -53.7 -48.57 69.41 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.169 0.509 . . . . 0.0 110.88 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 51.9 mt -59.71 -46.76 88.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.438 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 44.2 tt0 -58.81 -30.59 67.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 30' ' ' SER . 97.2 mt -62.24 -60.45 2.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.737 ' HB2' HD13 ' B' ' 6' ' ' LEU . 58.6 mt -59.95 -35.84 75.8 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 15.3 m-70 -61.63 -42.98 99.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.943 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.1 m -62.66 -37.17 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.167 0.508 . . . . 0.0 110.319 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.408 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 56.8 t80 -58.89 -61.39 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.47 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.598 ' HG3' HD23 ' B' ' 6' ' ' LEU . 13.8 mm100 -61.69 -45.9 92.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.375 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -56.28 -49.52 74.01 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -80.17 43.1 0.6 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.767 0.318 . . . . 0.0 111.262 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -152.23 -52.11 0.11 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.702 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.2 mt -72.57 -59.06 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.989 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -94.04 -41.11 9.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.601 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.4 m 66.71 130.27 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.993 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HD2' ' HA ' ' A' ' 46' ' ' LYS . 40.8 tptt -177.29 117.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.264 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.72 152.79 6.17 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.702 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.451 ' HG3' HH11 ' A' ' 48' ' ' ARG . 60.0 mtt85 -49.64 146.75 6.81 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.566 0.222 . . . . 0.0 110.957 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -49.0 144.52 15.5 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.969 2.446 . . . . 0.0 112.707 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -158.28 163.59 37.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.196 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -74.66 43.19 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.94 164.3 0.93 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.601 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.542 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 24.4 ttt -146.43 144.8 29.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.349 -0.426 . . . . 0.0 110.942 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.544 ' O ' HG23 ' A' ' 58' ' ' VAL . 78.8 p -169.31 -144.47 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.487 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -56.9 -31.04 64.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.838 0.352 . . . . 0.0 110.895 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 14.6 pt-20 -58.42 -50.28 74.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.9 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.542 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 28.2 tt0 -79.25 -44.7 21.23 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 54' ' ' SER . 65.7 t -52.83 -41.14 38.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.724 0.297 . . . . 0.0 110.848 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.47 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 21.0 t80 -61.71 -39.13 90.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.401 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 16.4 m -67.59 -50.83 56.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.882 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 57.8 mm-40 -56.88 -48.68 77.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.484 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.48 -44.99 82.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.81 0.338 . . . . 0.0 111.586 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.985 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.1 -44.2 97.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.506 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 1.1 p30 -62.42 -38.96 91.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.109 0.481 . . . . 0.0 110.247 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.476 HD12 HD11 ' A' ' 34' ' ' ILE . 3.0 mt -60.05 -63.1 1.42 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.191 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.5 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 9.8 m-30 -74.2 41.19 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.597 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -61.06 131.86 51.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.361 . . . . 0.0 110.531 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -45.35 3.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.562 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.484 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.61 53.88 2.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.035 0.445 . . . . 0.0 110.341 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 95.5 mt-10 -59.97 -5.54 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.023 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -60.85 -45.23 95.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.938 0.399 . . . . 0.0 110.018 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 17' ' ' ILE . 91.4 mt -71.98 -36.11 69.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.985 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.985 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -53.41 -44.25 68.59 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.73 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.479 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 67.3 m -53.47 -41.33 66.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.815 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.93 -46.91 70.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.08 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.566 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.9 t80 -57.7 -41.76 82.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.161 0.505 . . . . 0.0 110.021 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.68 -30.07 75.71 Favored Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.76 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 74' ' ' SER . 99.0 mm-40 -50.67 -47.06 58.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.714 0.292 . . . . 0.0 110.997 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -68.33 -48.36 65.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.037 0.446 . . . . 0.0 110.563 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 76' ' ' PHE . 25.3 mt -64.58 133.16 95.61 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.416 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.46 105.97 0.39 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 121.959 1.773 . . . . 0.0 111.91 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.15 144.15 56.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.902 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -160.86 -50.44 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.713 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -72.08 -150.71 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.756 0.312 . . . . 0.0 111.167 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 48.1 ttm-85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.901 -179.912 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.936 0.398 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.706 HG23 HD22 ' A' ' 35' ' ' LEU . 44.7 mm -71.45 -36.53 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.112 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -41.34 68.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.498 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 64.4 mtt -70.31 -42.54 71.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.212 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.64 HD11 ' HD2' ' A' ' 13' ' ' TYR . 19.6 tp -64.42 -49.08 72.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.824 0.345 . . . . 0.0 110.968 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.737 HD13 ' HB2' ' A' ' 35' ' ' LEU . 30.8 tp -63.45 -43.25 97.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -63.15 -34.45 77.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.158 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.616 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.15 -38.97 66.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.502 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.94 -45.22 74.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.002 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -63.72 -39.15 93.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.59 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -55.83 -54.21 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.506 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.578 HD13 ' HZ3' ' A' ' 18' ' ' LYS . 95.8 mt -63.69 -45.86 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.266 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.861 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.372 0.13 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.4 p 57.76 130.23 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.65 0.594 . . . . 0.0 111.809 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -70.86 -133.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.83 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 p -55.93 151.25 11.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.43 0.633 . . . . 0.0 112.179 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 72.8 t -55.38 -37.01 42.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.269 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 45.7 mt-10 -57.16 -36.41 70.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.159 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.527 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.6 t80 -58.95 -57.72 11.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.716 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -32.61 74.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.552 0.691 . . . . 0.0 109.33 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.8 t-20 -56.02 -42.33 76.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.27 -42.14 65.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.011 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HB1' ' B' ' 8' ' ' ALA . 41.8 mm -54.02 -42.99 57.07 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.817 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 m -54.53 -38.53 66.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.132 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 39.4 t80 -66.86 -57.46 6.96 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.931 0.396 . . . . 0.0 111.019 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' B' ' 9' ' ' ALA . 39.5 t -57.19 -43.89 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.269 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.54 -52.39 63.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.993 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HA ' HG22 ' A' ' 19' ' ' THR . 5.0 ttmp? -53.36 -40.08 64.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.0 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.708 HG12 HD13 ' A' ' 72' ' ' LEU . 91.9 mt -62.31 -38.19 80.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.19 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -68.97 -49.23 59.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.075 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.6 t -69.82 -27.97 65.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.654 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 20' ' ' ARG . 10.5 tpt180 -67.73 -58.45 4.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.571 ' HZ ' ' HG3' ' A' ' 69' ' ' GLN . 53.1 m-85 -90.94 38.89 0.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 72.7 mt -54.24 -34.87 61.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.044 0.449 . . . . 0.0 110.342 179.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.23 -37.22 61.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -105.42 78.69 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.121 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -59.04 -35.15 98.89 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.84 2.36 . . . . 0.0 112.809 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -50.84 -33.09 22.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.378 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.4 mm -64.54 -48.35 85.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.117 0.484 . . . . 0.0 111.036 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.543 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.0 t80 -59.27 -49.89 76.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.409 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -58.3 -56.17 25.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.041 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.638 ' HB2' HD11 ' A' ' 65' ' ' LEU . 60.7 m -53.44 -49.76 66.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.528 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.5 t80 -52.03 -49.68 62.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.986 0.422 . . . . 0.0 111.068 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 86.6 mt -58.66 -41.73 86.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.475 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.61 -30.25 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.121 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 30' ' ' SER . 78.1 mt -62.41 -55.1 26.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.832 HD22 HG23 ' B' ' 2' ' ' ILE . 54.2 mt -62.83 -38.62 91.51 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.449 0.643 . . . . 0.0 109.534 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.541 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 1.8 m-70 -60.82 -47.23 87.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.221 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.4 m -61.18 -37.02 81.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.151 0.5 . . . . 0.0 110.28 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.615 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 30.2 t80 -54.0 -60.21 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.162 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 14.2 mt-30 -60.47 -39.52 87.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.134 -179.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 28.6 mtpp -52.24 -54.45 30.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.619 0.247 . . . . 0.0 111.548 -179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' OE2' ' HA3' ' A' ' 52' ' ' GLY . 87.4 tt0 -72.99 -32.93 65.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.876 0.369 . . . . 0.0 110.742 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.535 HE21 ' HA ' ' A' ' 39' ' ' GLN . 7.5 tt0 -56.86 -40.53 76.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.517 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 80.7 mt -63.84 -147.72 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.803 0.335 . . . . 0.0 111.419 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -178.3 142.11 0.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.6 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 p -127.82 107.78 10.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.013 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER 47.72 45.38 18.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.159 179.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.55 148.31 8.03 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.885 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -52.27 143.41 25.92 Favored Pre-proline 0 C--N 1.332 -0.179 0 CA-C-O 120.625 0.25 . . . . 0.0 111.111 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.14 -160.89 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.68 2.254 . . . . 0.0 112.625 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -173.21 134.02 0.53 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.514 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -81.31 36.9 0.43 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.318 0.58 . . . . 0.0 110.898 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA3' ' OE2' ' A' ' 41' ' ' GLU . . . -62.24 -35.27 91.33 Favored Glycine 0 CA--C 1.509 -0.332 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.613 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.552 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 26.7 ttt -144.94 143.28 30.46 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.859 0.362 . . . . 0.0 111.026 -179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.615 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 10.3 t -162.05 -145.64 0.11 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.444 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.406 ' HG2' ' HD2' ' A' ' 81' ' ' PRO . 44.0 mp0 -61.0 -34.98 75.66 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.814 0.34 . . . . 0.0 111.161 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.439 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 16.0 pt-20 -56.27 -49.53 73.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.053 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.552 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 75.9 tt0 -74.47 -46.53 39.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 54' ' ' SER . 59.6 t -53.55 -45.79 59.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.822 0.344 . . . . 0.0 110.832 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.581 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.4 t80 -60.23 -34.74 74.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.278 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.4 m -66.93 -58.81 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.048 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -56.72 -44.32 81.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.396 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.505 HG23 HG21 ' A' ' 34' ' ' ILE . 90.1 t -64.05 -42.17 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.474 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.37 -40.54 94.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.087 0.47 . . . . 0.0 110.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -61.29 -42.66 99.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.698 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.638 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.5 mt -67.13 -62.7 1.3 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.316 0.579 . . . . 0.0 110.952 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 66' ' ' PHE . 3.3 m-30 -73.11 37.47 0.08 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.634 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' A' ' 69' ' ' GLN . 41.8 ttm180 -58.48 130.84 48.68 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.36 -31.83 2.1 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.764 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.571 ' HG3' ' HZ ' ' A' ' 21' ' ' PHE . 6.4 mm-40 -78.04 48.76 0.75 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.911 0.386 . . . . 0.0 110.492 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 4.9 mm-40 -56.08 -14.49 2.67 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.27 -49.83 75.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.639 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.708 HD13 HG12 ' A' ' 17' ' ' ILE . 88.0 mt -70.0 -34.04 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.234 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 1.3 mm? -58.51 -37.38 75.48 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.262 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 74.8 m -54.71 -39.26 68.01 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.322 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.51 -45.27 22.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.292 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.8 t80 -57.23 -43.78 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.134 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -39.59 96.69 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.989 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 74' ' ' SER . 26.1 mt-30 -53.62 -46.77 70.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.774 0.321 . . . . 0.0 111.14 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.706 ' HB3' ' HB2' ' B' ' 1' ' ' ASN . 2.4 m-85 -65.76 -42.73 90.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.632 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.542 HD23 HD21 ' B' ' 1' ' ' ASN . 83.8 mt -62.85 134.78 95.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.747 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.406 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 45.3 Cg_endo -69.09 114.6 3.65 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.251 1.967 . . . . 0.0 112.505 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 178.79 -55.16 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.841 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.57 133.36 46.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.26 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -175.37 46.39 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.021 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.965 179.662 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.706 ' HB2' ' HB3' ' A' ' 79' ' ' PHE . 15.6 p-10 . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.782 0.325 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.832 HG23 HD22 ' A' ' 35' ' ' LEU . 45.9 mm -62.86 -40.12 87.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.178 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -54.75 -40.97 69.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.753 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 50.8 ttm -65.4 -45.38 84.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.498 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HB1' ' A' ' 10' ' ' ALA . 61.5 mt -65.66 -50.22 65.76 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.654 0.264 . . . . 0.0 111.2 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.643 HD13 ' HB2' ' A' ' 35' ' ' LEU . 38.8 tp -58.02 -41.02 82.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.084 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -66.27 -37.54 85.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.287 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.747 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -59.16 -42.71 91.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.266 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.476 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.83 -46.84 81.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.119 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' B' ' 13' ' ' GLU . 8.2 t70 -57.47 -38.58 74.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.268 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' B' ' 8' ' ' ALA . 57.1 t80 -60.47 -50.66 72.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.436 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.437 HD21 ' CG2' ' A' ' 11' ' ' ILE . 86.2 mt -63.09 -49.81 73.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.804 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' B' ' 10' ' ' ASP . 16.4 pt-20 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.867 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . 0.419 ' OE1' ' N ' ' A' ' 1' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.703 0.287 . . . . 0.0 111.046 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -177.94 51.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.925 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -161.56 133.85 5.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.873 0.368 . . . . 0.0 111.273 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -65.35 142.49 58.21 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.184 0.516 . . . . 0.0 111.473 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.441 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 96.6 t -62.24 -41.37 91.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.404 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.2 mt-10 -56.83 -37.26 70.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.606 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.587 ' O ' HG12 ' A' ' 11' ' ' ILE . 16.4 t80 -59.54 -57.74 11.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.626 0.251 . . . . 0.0 110.716 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -32.21 73.74 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.471 0.653 . . . . 0.0 109.267 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.459 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.4 t-20 -55.43 -44.3 76.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.708 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.42 -42.69 64.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.827 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 7' ' ' PHE . 48.8 mm -51.63 -54.26 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.112 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.6 p -51.03 -33.62 26.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.781 ' HD2' HD11 ' B' ' 5' ' ' LEU . 30.9 t80 -63.2 -48.72 77.15 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.502 HG21 ' HB3' ' B' ' 8' ' ' ALA . 32.3 t -68.3 -40.24 82.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.742 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -62.24 -42.72 99.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.908 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.2 ttmt -66.24 -39.34 89.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.36 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 13' ' ' TYR . 85.7 mt -60.02 -40.82 84.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.175 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -64.47 -56.77 11.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.6 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 16' ' ' LYS . 14.5 t -62.69 -29.67 70.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.008 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -68.09 -59.6 3.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.929 0.395 . . . . 0.0 111.283 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.549 ' CD2' HG13 ' A' ' 27' ' ' ILE . 60.3 m-85 -91.75 39.17 1.0 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.09 -37.24 53.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.964 0.411 . . . . 0.0 110.577 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.92 -37.46 58.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -104.16 78.61 0.34 Allowed Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.269 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -59.35 -35.42 96.69 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.87 2.38 . . . . 0.0 112.602 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -51.07 -33.12 24.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.048 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.5 mm -64.44 -51.28 70.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.804 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 49.0 t80 -58.03 -47.73 82.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.629 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.419 HH11 ' HG2' ' A' ' 29' ' ' ARG . 49.7 mmt-85 -55.97 -52.22 64.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.319 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.629 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.0 m -53.69 -52.82 58.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.522 -179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -50.16 -51.67 41.66 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.088 0.47 . . . . 0.0 110.97 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 74.4 mt -58.17 -44.55 88.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.41 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 17.6 tp10 -62.13 -29.18 70.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.691 179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.643 HG22 HG13 ' A' ' 58' ' ' VAL . 72.2 mt -64.33 -56.75 14.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.021 0.438 . . . . 0.0 109.935 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.79 HD22 HG23 ' B' ' 2' ' ' ILE . 56.9 mt -62.71 -40.08 96.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.458 0.647 . . . . 0.0 109.322 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.508 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 12.1 m-70 -59.14 -47.5 85.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.546 HG22 ' SD ' ' A' ' 53' ' ' MET . 76.5 m -59.86 -38.4 82.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.738 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.443 ' HB2' ' HE1' ' A' ' 53' ' ' MET . 39.5 t80 -58.28 -53.81 54.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.669 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.457 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.2 mm100 -66.09 -43.64 86.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.967 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 99.1 mttt -56.79 -46.78 81.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.714 0.292 . . . . 0.0 111.307 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 41' ' ' GLU . 37.4 tt0 -80.05 42.33 0.56 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.181 0.515 . . . . 0.0 110.818 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -156.47 -41.84 0.07 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 95.5 mt -57.01 -41.79 79.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.243 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.49 130.66 1.37 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 111.147 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 81.9 p -98.66 136.98 37.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.416 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.712 ' HZ2' ' H ' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -66.26 -32.8 74.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.582 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -156.05 -140.67 3.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.381 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -65.56 134.59 95.51 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.678 0.275 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -75.6 148.76 33.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.739 2.293 . . . . 0.0 112.481 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -162.74 133.08 4.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.584 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HG3' HH11 ' A' ' 51' ' ' ARG . 0.0 OUTLIER 57.03 56.67 5.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.384 0.611 . . . . 0.0 110.062 -179.706 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.3 137.82 44.3 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.23 -0.896 . . . . 0.0 113.253 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.546 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.2 ttt -95.86 146.73 24.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.727 -0.736 . . . . 0.0 110.992 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.628 ' O ' HG23 ' A' ' 58' ' ' VAL . 80.9 p -154.5 -159.35 0.95 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.059 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -62.56 -35.11 78.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.533 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.538 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 11.9 pt-20 -58.57 -47.56 83.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.506 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 60' ' ' THR . 24.0 tt0 -71.09 -44.5 65.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.523 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.643 HG13 HG22 ' A' ' 34' ' ' ILE . 61.0 t -53.66 -43.46 54.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.872 0.368 . . . . 0.0 110.358 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 31.3 t80 -61.74 -33.61 74.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.197 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 45.3 m -68.0 -57.2 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.138 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -57.32 -43.06 83.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.513 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 58' ' ' VAL . 89.4 t -64.16 -41.35 92.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 110.119 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.784 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.63 -40.92 93.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -63.28 -37.55 87.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.936 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.546 HD22 HG23 ' A' ' 27' ' ' ILE . 5.6 mt -65.63 -65.45 0.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.494 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.708 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.3 m-30 -76.03 44.9 0.33 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.562 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -62.69 137.23 58.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.66 -43.98 2.87 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.295 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 71' ' ' ASP . 16.9 pt20 -96.16 56.45 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.757 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 57.8 mp0 -65.81 8.36 0.19 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.153 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 69' ' ' GLN . 7.3 t70 -61.49 -44.64 96.72 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.5 mt -70.25 -38.59 75.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.596 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.784 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -55.19 -39.77 69.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.946 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.7 t -56.13 -40.24 73.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.525 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -68.39 -44.45 75.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.793 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.605 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 16.0 t80 -56.97 -42.0 79.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.803 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.53 -40.63 96.53 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.763 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -53.35 -42.41 66.78 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.73 0.3 . . . . 0.0 111.042 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.34 -44.9 93.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.99 0.424 . . . . 0.0 110.497 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.646 HD21 HD11 ' B' ' 2' ' ' ILE . 67.1 mt -63.89 139.24 97.61 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.708 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.41 137.82 80.51 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.621 2.214 . . . . 0.0 112.146 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -78.08 40.19 0.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.464 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.77 -170.45 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.71 0.29 . . . . 0.0 111.127 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.489 ' C ' ' HD3' ' A' ' 84' ' ' LYS . 8.0 tmtm? -177.27 123.14 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.213 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' A' ' 84' ' ' LYS . 3.5 ptp85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.072 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.88 0.372 . . . . 0.0 111.266 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.79 HG23 HD22 ' A' ' 35' ' ' LEU . 47.4 mm -56.51 -36.0 46.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.814 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -57.51 -45.37 85.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.571 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 77.4 mtp -71.89 -43.61 65.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.722 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.781 HD11 ' HD2' ' A' ' 13' ' ' TYR . 18.9 tp -61.05 -51.33 69.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.825 0.345 . . . . 0.0 110.795 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.709 HD13 ' HB2' ' A' ' 35' ' ' LEU . 29.8 tp -60.76 -38.42 85.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.098 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.85 -35.62 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.577 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -54.25 -39.61 66.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.317 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -54.66 -44.48 73.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.204 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -63.6 -39.29 94.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.928 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.429 ' HD2' HD12 ' A' ' 11' ' ' ILE . 43.1 t80 -57.85 -54.5 46.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.52 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -63.05 -47.38 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.114 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.871 179.96 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.807 0.337 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t -171.08 133.43 0.88 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.808 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.2 131.86 50.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.823 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.3 p -63.84 150.77 44.05 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 112.049 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 76.7 t -55.26 -37.26 43.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.122 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.3 mt-10 -59.67 -35.27 74.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.364 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.453 ' O ' HG12 ' A' ' 11' ' ' ILE . 15.4 t80 -59.84 -56.76 17.77 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.514 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -33.81 76.79 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.469 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.5 t-20 -55.62 -41.42 73.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.809 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.706 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.28 -39.11 71.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.778 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.602 HD13 ' HB1' ' B' ' 8' ' ' ALA . 37.7 mm -52.61 -42.59 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.271 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.1 t -54.96 -38.03 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.107 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.608 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 17.6 t80 -67.48 -56.91 7.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.444 HG21 ' HB3' ' B' ' 8' ' ' ALA . 44.6 t -57.33 -40.43 74.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.217 0.532 . . . . 0.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.02 -54.97 21.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.053 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HA ' HG22 ' A' ' 19' ' ' THR . 63.4 tttm -53.71 -39.72 65.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.06 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.595 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 87.2 mt -62.73 -37.57 79.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.822 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -66.12 -47.93 72.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.916 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -70.74 -28.86 65.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.176 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.563 ' HG2' HD11 ' A' ' 72' ' ' LEU . 26.4 tpt180 -65.22 -56.7 11.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.49 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.3 m-85 -91.89 40.35 1.04 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.604 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 19' ' ' THR . 35.7 mt -56.61 -31.88 64.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.934 0.397 . . . . 0.0 110.649 179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -74.71 -38.05 62.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.315 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.43 ' HB3' HG12 ' A' ' 27' ' ' ILE . 90.9 m-70 -106.66 78.92 0.59 Allowed Pre-proline 0 N--CA 1.447 -0.581 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.741 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.43 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 20.8 Cg_endo -58.98 -35.02 99.34 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.765 2.31 . . . . 0.0 112.604 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -53.01 -29.66 30.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.186 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.689 HG23 HD22 ' A' ' 65' ' ' LEU . 15.5 mm -64.25 -49.31 81.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.37 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.62 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.4 t80 -55.59 -50.83 69.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.847 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.43 -51.03 71.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.477 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.566 ' O ' HG13 ' A' ' 34' ' ' ILE . 48.3 t -52.31 -53.65 41.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.352 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -50.47 -50.36 52.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.254 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 29.4 mt -59.92 -40.55 89.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.4 mm-40 -64.73 -32.7 74.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.193 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 30' ' ' SER . 75.9 mt -61.47 -54.17 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 120.867 0.365 . . . . 0.0 110.367 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.673 HD22 HG23 ' B' ' 2' ' ' ILE . 77.5 mt -61.92 -42.3 98.93 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.475 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.4 OUTLIER -56.56 -46.16 80.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.918 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.583 HG22 ' SD ' ' A' ' 53' ' ' MET . 95.8 m -48.45 -34.76 11.59 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.971 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.495 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 68.1 t80 -55.83 -52.9 62.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.297 0.57 . . . . 0.0 110.813 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -70.46 -34.46 72.45 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.692 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 75.2 mmtt -52.72 -47.99 66.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.807 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.83 -43.75 92.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.685 0.278 . . . . 0.0 111.578 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -65.71 -33.44 75.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.353 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.34 45.19 0.45 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.025 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.2 m170 -121.91 5.55 9.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.642 0.258 . . . . 0.0 110.828 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.738 HG22 ' HG2' ' A' ' 46' ' ' LYS . 22.6 m 62.86 140.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.352 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.738 ' HG2' HG22 ' A' ' 45' ' ' THR . 46.4 mmtm 62.75 140.69 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.331 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.47 125.66 1.28 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.346 -0.931 . . . . 0.0 112.955 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 48' ' ' ARG . 69.6 mtt-85 -81.81 146.73 56.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.535 0.207 . . . . 0.0 110.938 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.481 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 9.5 Cg_endo -52.22 144.33 39.14 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.82 2.347 . . . . 0.0 111.655 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.5 ' O ' ' HB3' ' A' ' 51' ' ' ARG . 36.2 t80 70.09 155.04 0.13 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.704 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 50' ' ' PHE . 40.0 ttm-85 70.02 104.0 0.06 Allowed 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.303 0.573 . . . . 0.0 110.605 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.51 132.64 1.45 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.789 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.595 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 24.2 ttt -57.29 148.05 23.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.029 -0.586 . . . . 0.0 111.816 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.503 ' O ' HG23 ' A' ' 58' ' ' VAL . 79.5 p -166.56 -146.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.533 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.9 mp0 -58.31 -29.93 66.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.318 . . . . 0.0 111.023 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 14.5 pt-20 -58.42 -50.73 72.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.014 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.595 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 29.0 tt0 -82.12 -44.69 16.17 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.531 HG11 HD12 ' B' ' 2' ' ' ILE . 88.2 t -53.04 -44.9 52.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.171 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.605 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 18.0 t80 -61.92 -34.21 75.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.907 0.384 . . . . 0.0 110.688 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.9 m -66.06 -56.68 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.14 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HB2' HG23 ' A' ' 34' ' ' ILE . 58.7 mm-40 -58.6 -44.93 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.629 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.531 HG23 HG21 ' A' ' 34' ' ' ILE . 99.6 t -64.05 -42.47 95.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.736 0.303 . . . . 0.0 110.406 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.55 97.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.226 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -58.63 -41.72 86.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.039 179.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.689 HD22 HG23 ' A' ' 27' ' ' ILE . 4.8 mt -63.37 -60.18 3.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.555 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.567 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 5.3 m-30 -73.52 39.17 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.957 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.411 HH11 ' HG2' ' A' ' 67' ' ' ARG . 52.2 ttp85 -61.63 128.92 38.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.789 0.328 . . . . 0.0 110.42 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.19 -41.78 2.67 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.283 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -83.96 57.87 4.4 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.93 0.395 . . . . 0.0 110.998 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -63.65 -3.3 2.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.51 -54.98 36.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.925 0.393 . . . . 0.0 110.686 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' HG2' ' A' ' 20' ' ' ARG . 49.9 mt -68.62 -42.78 77.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.509 0.671 . . . . 0.0 109.933 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 tp -51.97 -38.14 55.57 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.206 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 39.3 t -55.73 -42.83 75.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 46.4 mt-10 -63.98 -45.29 89.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.292 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.608 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 16.3 t80 -57.54 -44.37 85.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.524 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.4 -28.94 70.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.785 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 74' ' ' SER . 97.9 mm-40 -49.93 -46.56 52.21 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.731 0.301 . . . . 0.0 111.27 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -71.33 -43.63 66.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 59' ' ' PHE . 50.8 mt -63.28 142.04 97.8 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.169 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.28 -162.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.462 2.108 . . . . 0.0 112.179 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 60.37 56.63 3.12 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 121.02 0.438 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.82 -135.2 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.586 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -54.35 -36.37 63.74 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 120.65 0.262 . . . . 0.0 111.207 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.746 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.563 HD22 ' N ' ' B' ' 1' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.828 0.347 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.673 HG23 HD22 ' A' ' 35' ' ' LEU . 45.5 mm 73.28 -45.4 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.516 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -33.91 77.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.073 0.464 . . . . 0.0 109.779 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.3 ttm -62.62 -49.01 76.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.634 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.706 HD23 ' HB1' ' A' ' 10' ' ' ALA . 79.3 mt -68.9 -46.05 69.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.48 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 35' ' ' LEU . 45.5 tp -56.22 -39.88 73.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.07 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.62 -39.73 77.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.237 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.602 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -55.71 -39.47 71.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.112 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.62 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.24 -46.49 79.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.369 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -60.48 -39.2 86.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.669 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.83 -54.82 42.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.422 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 98.8 mt -64.99 -47.08 78.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.116 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.971 -179.77 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.818 0.342 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 t -60.89 -45.46 94.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.777 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 4' ' ' SER . 48.1 t0 -172.12 -137.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.847 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.455 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 25.9 t -74.94 152.26 38.82 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.22 0.533 . . . . 0.0 110.908 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.588 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 83.7 t -61.0 -34.71 60.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.594 178.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.542 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 92.2 mt-10 -61.25 -39.44 90.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.015 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.501 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.2 t80 -63.33 -53.03 59.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -62.68 -32.17 73.19 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.0 t-20 -59.38 -41.28 88.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.543 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.599 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.07 -40.84 68.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.438 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.76 HD13 ' HB1' ' B' ' 8' ' ' ALA . 43.5 mm -54.27 -42.04 55.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 CA-C-O 120.964 0.411 . . . . 0.0 110.299 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.1 m -56.75 -38.17 72.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.594 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 15.5 t80 -68.43 -55.31 12.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.948 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.9 -44.24 90.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.126 0.489 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -60.18 -55.39 34.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.813 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.534 ' HA ' HG22 ' A' ' 19' ' ' THR . 65.6 tttm -56.42 -40.94 75.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.883 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 78.3 mt -60.49 -47.77 91.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.904 0.383 . . . . 0.0 110.64 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 38.7 ttpt -62.85 -56.68 15.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.751 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.0 t -57.29 -29.64 64.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.179 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -70.01 -55.65 9.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.768 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.489 ' CD2' HG13 ' A' ' 27' ' ' ILE . 57.2 m-85 -91.19 38.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.904 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 19' ' ' THR . 67.5 mt -52.8 -34.47 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.913 0.387 . . . . 0.0 110.675 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -75.31 -38.99 60.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -106.27 78.25 0.5 Allowed Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.234 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.98 -34.81 94.8 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.671 2.247 . . . . 0.0 112.458 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.0 -31.26 17.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.022 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG23 HD22 ' A' ' 65' ' ' LEU . 8.8 mm -64.33 -47.57 89.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 18' ' ' LYS . 62.0 t80 -58.51 -45.77 88.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.2 mmt-85 -60.01 -56.51 20.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.611 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.579 ' O ' HG13 ' A' ' 34' ' ' ILE . 50.2 m -51.08 -49.14 61.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.988 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.8 t80 -51.23 -50.37 59.27 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.703 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.1 mt -60.22 -39.75 87.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.681 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.51 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.227 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.744 HG22 HG13 ' A' ' 58' ' ' VAL . 85.3 mt -61.47 -56.85 15.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.119 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.773 HD22 HG23 ' B' ' 2' ' ' ILE . 65.1 mt -60.7 -38.08 83.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.233 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.458 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 1.5 m-70 -62.26 -38.39 89.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.225 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 93.3 m -64.24 -45.57 87.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.079 0.466 . . . . 0.0 110.648 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.506 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 33.9 t80 -63.81 -46.81 83.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.936 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.42 -47.07 71.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.224 -178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 36' ' ' HIS . 16.3 ttpp -52.87 -44.16 66.64 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 120.827 0.346 . . . . 0.0 111.032 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -42.02 94.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.417 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.566 ' O ' HG23 ' A' ' 45' ' ' THR . 8.4 tt0 -58.36 -28.65 65.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.871 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.53 -37.39 83.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.397 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -86.81 -30.55 21.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.716 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.566 HG23 ' O ' ' A' ' 42' ' ' GLN . 50.9 p 52.86 45.0 29.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.577 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -149.38 43.35 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.044 0.449 . . . . 0.0 110.713 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.4 141.06 33.19 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.412 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.41 HH11 ' HG2' ' A' ' 48' ' ' ARG . 50.0 mtp85 -50.83 143.01 15.74 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.409 -0.396 . . . . 0.0 111.14 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -60.45 134.28 54.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.721 2.281 . . . . 0.0 112.263 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.8 t80 65.82 144.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.784 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 52.54 33.99 14.58 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.61 -122.08 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.061 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.506 ' HE3' ' HB2' ' A' ' 38' ' ' TYR . 18.0 tpt -157.17 122.37 4.57 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.885 0.374 . . . . 0.0 110.768 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.58 ' O ' HG23 ' A' ' 58' ' ' VAL . 72.7 m -156.69 -150.38 0.28 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.608 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 -69.62 -32.94 71.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.067 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -57.08 -47.63 80.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.786 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' HG2' ' SD ' ' A' ' 53' ' ' MET . 4.5 tp10 -68.98 -51.75 36.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.685 0.279 . . . . 0.0 111.275 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.744 HG13 HG22 ' A' ' 34' ' ' ILE . 43.2 t -53.14 -44.05 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.216 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.588 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 35.3 t80 -60.15 -37.09 79.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.588 HG22 HD21 ' A' ' 64' ' ' ASN . 87.1 m -73.29 -48.06 37.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.805 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.82 -46.6 81.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.705 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 58' ' ' VAL . 74.4 t -64.69 -42.35 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.024 179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.29 -41.05 88.05 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 109.959 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.588 HD21 HG22 ' A' ' 60' ' ' THR . 71.2 m-20 -61.36 -40.09 93.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.532 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.558 HD22 HG23 ' A' ' 27' ' ' ILE . 6.3 mt -67.27 -63.94 0.96 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 179.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.789 ' HB2' HD23 ' A' ' 73' ' ' LEU . 4.5 m-30 -74.85 42.76 0.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.793 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -62.16 137.92 58.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.863 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.01 -45.01 2.69 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.016 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.43 ' H ' ' HG2' ' A' ' 69' ' ' GLN . 4.8 pt20 -95.56 51.83 1.32 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.143 0.496 . . . . 0.0 110.277 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -66.96 7.32 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.97 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.42 -45.09 95.78 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.401 HD21 ' NZ ' ' A' ' 16' ' ' LYS . 41.9 mt -69.12 -36.15 77.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.077 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 66' ' ' PHE . 0.1 OUTLIER -54.91 -40.27 69.67 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.705 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.8 t -56.04 -40.66 73.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.474 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -66.96 -38.47 86.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.064 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 15.4 t80 -57.5 -45.55 84.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.779 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.25 -34.85 75.49 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.276 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.905 0.383 . . . . 0.0 110.795 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -72.08 -44.96 62.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.698 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' A' ' 76' ' ' PHE . 91.0 mt -59.56 140.36 88.94 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.969 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.78 127.84 20.63 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.544 2.163 . . . . 0.0 112.512 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -85.87 57.87 4.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -155.29 53.85 0.62 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.5 -147.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.819 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.89 179.939 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.939 0.399 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.773 HG23 HD22 ' A' ' 35' ' ' LEU . 46.5 mm -64.14 -36.35 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.034 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -32.06 63.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.363 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.24 -45.75 91.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.086 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.599 HD23 ' HB1' ' A' ' 10' ' ' ALA . 66.1 mt -68.64 -46.21 69.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.058 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.5 mt -57.72 -46.27 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -68.08 -37.26 81.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.552 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.76 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -58.52 -44.14 89.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.607 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.32 -43.16 96.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.395 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.14 -48.34 82.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 110.742 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -61.57 -56.58 18.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.387 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.479 HD13 ' CG2' ' A' ' 11' ' ' ILE . 22.5 tp -56.01 -48.59 75.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.752 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.928 179.745 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.335 0.112 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t 61.63 -82.83 0.02 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.175 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -66.3 126.78 29.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.873 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -68.94 145.95 53.2 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.078 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.438 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 86.0 t -59.57 -39.6 79.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.962 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 90.8 mt-10 -57.35 -34.74 69.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.846 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.525 ' O ' HG12 ' A' ' 11' ' ' ILE . 16.7 t80 -60.69 -60.33 3.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.294 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -62.03 -31.28 71.67 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 39.0 t-20 -57.43 -43.56 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.802 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.584 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.33 -39.11 68.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.834 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 7' ' ' PHE . 46.7 mm -54.42 -44.93 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.172 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.096 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.9 p -58.5 -33.51 69.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.835 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.584 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 34.1 t80 -63.0 -53.26 56.8 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.455 HG11 ' HA ' ' B' ' 9' ' ' ALA . 45.3 t -63.77 -40.06 87.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.929 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -62.14 -45.5 93.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.136 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.2 tttt -65.57 -39.35 91.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.541 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 13' ' ' TYR . 84.0 mt -60.93 -41.17 87.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.511 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -65.5 -56.18 13.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.602 179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -60.08 -29.13 68.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.472 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -66.55 -55.37 15.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.918 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.701 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 51.1 m-85 -97.2 45.73 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.022 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -52.27 -43.31 64.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.87 0.367 . . . . 0.0 110.933 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.08 -22.03 45.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.624 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.701 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.9 m170 -109.69 72.19 0.58 Allowed Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.482 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -66.05 -34.85 36.3 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.495 2.13 . . . . 0.0 112.379 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -52.28 -34.49 46.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.412 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.29 -45.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.127 0.489 . . . . 0.0 110.423 -179.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.401 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.1 t80 -53.44 -49.45 67.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.327 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -60.09 -54.61 43.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.759 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.588 ' OG ' HD11 ' A' ' 65' ' ' LEU . 36.1 t -51.56 -49.94 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.232 -179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.471 ' CZ ' HD11 ' A' ' 35' ' ' LEU . 36.2 t80 -53.52 -50.18 65.98 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.907 0.384 . . . . 0.0 110.94 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 96.0 mt -59.18 -37.3 77.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -62.41 -35.97 80.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.942 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.582 HD11 HD12 ' A' ' 65' ' ' LEU . 56.8 mt -61.69 -56.91 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.142 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.573 HD22 HG23 ' B' ' 2' ' ' ILE . 89.0 mt -57.86 -39.13 77.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.345 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -62.2 -40.05 94.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.872 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.483 HG22 ' SD ' ' A' ' 53' ' ' MET . 99.8 m -60.49 -40.17 90.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.228 0.537 . . . . 0.0 110.155 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.499 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 52.2 t80 -63.68 -60.82 2.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.516 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -58.56 -43.94 89.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.632 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.568 ' NZ ' ' HB3' ' A' ' 40' ' ' LYS . 3.0 ttpm? -51.02 -52.53 42.08 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -71.72 -37.37 70.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.812 0.339 . . . . 0.0 111.351 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -51.05 -41.82 60.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.252 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.0 -85.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.831 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -179.99 34.89 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.942 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.4 p -79.2 -140.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.363 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -66.06 148.2 52.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.882 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.84 131.76 1.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.665 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' A' ' 48' ' ' ARG . 59.4 mtt85 -70.82 134.03 86.11 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.637 0.256 . . . . 0.0 111.33 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.491 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 54.9 Cg_endo -67.88 -156.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.598 2.199 . . . . 0.0 111.87 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.491 ' HB3' ' O ' ' A' ' 49' ' ' PRO . 22.9 t80 71.85 62.68 0.14 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.096 0.474 . . . . 0.0 110.9 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.491 ' HB3' ' O ' ' A' ' 50' ' ' PHE . 48.1 ttt-85 72.1 110.08 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.015 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -162.32 -38.63 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.21 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.09 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.483 ' SD ' HG22 ' A' ' 37' ' ' THR . 28.0 ttt -161.66 145.9 12.88 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.431 -0.385 . . . . 0.0 110.831 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.499 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 75.0 p -164.65 -143.76 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.643 ' HG3' HD22 ' A' ' 80' ' ' LEU . 8.6 mp0 -64.26 -28.87 70.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.728 0.299 . . . . 0.0 111.192 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -54.25 -46.95 72.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.791 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -81.42 -52.32 7.39 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.581 HG13 HG22 ' A' ' 34' ' ' ILE . 39.2 t -52.3 -47.38 45.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.689 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.568 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.1 t80 -59.89 -35.34 74.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.537 HG22 HD21 ' A' ' 64' ' ' ASN . 85.5 m -75.35 -52.74 10.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 112.021 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' OE1' ' HA ' ' A' ' 61' ' ' GLU . 4.3 tp10 -57.1 -43.96 82.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.692 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.56 HG23 HG21 ' A' ' 34' ' ' ILE . 72.9 t -64.87 -45.25 95.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.246 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -58.95 -41.08 86.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.21 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.537 HD21 HG22 ' A' ' 60' ' ' THR . 70.6 m-20 -58.99 -39.91 83.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.196 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.588 HD11 ' OG ' ' A' ' 30' ' ' SER . 4.9 mt -69.18 -61.84 1.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.578 178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 66' ' ' PHE . 4.2 m-30 -73.73 38.38 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.649 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -58.59 133.76 56.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 110.143 -0.318 . . . . 0.0 110.143 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.61 -42.0 3.0 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.881 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.464 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.5 OUTLIER -77.91 52.3 1.04 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.871 0.367 . . . . 0.0 110.773 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -58.75 -15.26 11.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.65 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.48 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.6 p30 -60.92 -40.12 91.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.581 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 17' ' ' ILE . 97.6 mt -72.12 -40.77 67.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.001 0.429 . . . . 0.0 110.364 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.401 HD21 ' HA ' ' A' ' 63' ' ' ALA . 2.0 mm? -57.47 -33.64 68.19 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.062 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.541 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 35.3 t -58.14 -40.47 81.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.247 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -72.59 -44.73 61.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.522 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.584 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 11.8 t80 -57.23 -40.43 77.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.802 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.41 -34.14 86.95 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.079 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 74' ' ' SER . 86.3 mt-30 -49.66 -51.72 35.93 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.711 0.291 . . . . 0.0 111.469 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.529 ' HB3' ' OD1' ' B' ' 1' ' ' ASN . 3.2 m-85 -69.28 -44.81 71.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.201 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.643 HD22 ' HG3' ' A' ' 55' ' ' GLU . 82.0 mt -62.88 135.77 96.18 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.621 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.521 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 96.1 Cg_endo -78.33 58.88 6.86 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.831 2.354 . . . . 0.0 112.252 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -48.95 132.18 18.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.937 0.399 . . . . 0.0 111.308 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -109.66 -49.22 3.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -152.6 134.55 14.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.778 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.519 ' N ' ' HD3' ' A' ' 85' ' ' ARG . 1.2 mpp_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.775 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 79' ' ' PHE . 19.6 p30 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 121.133 0.492 . . . . 0.0 111.451 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.573 HG23 HD22 ' A' ' 35' ' ' LEU . 50.3 mm -75.12 -27.58 19.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -50.73 -37.53 42.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.604 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 59.6 mtt -58.56 -39.35 80.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.015 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.584 HD23 ' HB1' ' A' ' 10' ' ' ALA . 20.3 mt -71.7 -46.59 58.27 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.485 ' CD2' HG22 ' B' ' 2' ' ' ILE . 4.1 mm? -57.03 -42.51 80.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.518 0.675 . . . . 0.0 109.406 178.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -69.43 -36.51 76.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.856 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.495 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -61.32 -44.91 96.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.591 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.455 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.61 -41.73 73.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.876 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.87 -38.82 89.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.661 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -56.47 -54.0 50.81 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.972 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.36 -43.48 81.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.539 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.119 179.617 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.649 0.261 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.1 p -174.62 132.7 0.36 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.5 p-10 -173.69 -134.85 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.795 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.9 140.75 55.01 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.196 0.522 . . . . 0.0 111.188 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 85.3 t -63.76 -41.86 94.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.285 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 46.7 mt-10 -56.63 -36.76 69.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.63 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.471 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.8 t80 -59.15 -57.01 14.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.702 0.287 . . . . 0.0 110.519 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -33.11 75.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.442 ' HB3' ' O ' ' A' ' 6' ' ' GLU . 37.6 t-20 -55.45 -41.01 72.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.651 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.686 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.92 -41.22 68.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.934 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.612 HD13 ' CB ' ' B' ' 8' ' ' ALA . 31.5 mm -50.91 -44.25 26.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.614 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 t -53.94 -41.61 67.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.506 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.511 ' O ' HG13 ' A' ' 17' ' ' ILE . 29.2 t80 -65.77 -56.61 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.829 0.347 . . . . 0.0 111.088 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.7 t -58.26 -43.49 86.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.341 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -58.07 -55.4 35.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.885 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.52 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.63 -38.97 64.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 13' ' ' TYR . 79.4 mt -61.23 -43.14 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.557 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -65.03 -56.46 12.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.751 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.52 HG22 ' HA ' ' A' ' 16' ' ' LYS . 12.2 t -59.53 -31.62 69.57 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.818 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.5 tpt85 -68.78 -56.93 6.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.92 0.391 . . . . 0.0 111.359 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.479 ' CD2' HG13 ' A' ' 27' ' ' ILE . 70.9 m-85 -93.43 38.94 1.05 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.209 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 19' ' ' THR . 75.8 mt -53.94 -35.22 61.5 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 110.837 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -75.13 -38.9 60.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.888 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -106.33 79.82 0.64 Allowed Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.541 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 24.1 Cg_endo -58.84 -37.72 92.32 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.901 2.401 . . . . 0.0 112.651 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -48.58 -33.74 10.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.218 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.487 HG23 HD22 ' A' ' 65' ' ' LEU . 5.2 mm -64.43 -48.91 83.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.782 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.504 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 47.0 t80 -57.54 -50.84 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.87 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -56.21 -51.58 67.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.37 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.553 ' CB ' HD11 ' A' ' 65' ' ' LEU . 51.5 m -50.27 -50.5 50.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.071 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' ILE . 57.2 t80 -53.35 -47.03 69.74 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.159 0.504 . . . . 0.0 110.611 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 66.3 mt -59.91 -42.69 94.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.354 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -61.55 -31.69 71.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.015 178.75 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.691 HG22 HG13 ' A' ' 58' ' ' VAL . 78.0 mt -60.63 -58.19 8.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.42 . . . . 0.0 109.935 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.844 HD22 HG23 ' B' ' 2' ' ' ILE . 89.5 mt -60.33 -38.57 84.16 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 11.3 m-70 -58.98 -40.81 85.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.707 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.568 HG22 ' SD ' ' A' ' 53' ' ' MET . 92.9 m -60.71 -36.3 78.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.075 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.541 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 50.2 t80 -60.88 -57.89 10.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.076 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.3 mm100 -62.22 -40.67 96.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.64 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.54 ' O ' HG23 ' A' ' 45' ' ' THR . 67.6 mttm -48.44 -52.82 20.35 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' ' OG1' ' A' ' 45' ' ' THR . 50.3 mt-10 -64.07 -39.83 94.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.665 0.269 . . . . 0.0 111.218 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.901 ' HA ' ' HB3' ' A' ' 49' ' ' PRO . 8.3 tt0 -64.48 -31.78 73.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.1 mt -56.59 -79.94 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.537 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -176.15 42.49 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.0 111.389 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 40' ' ' LYS . 42.9 p -69.39 -126.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.15 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -44.32 -38.3 3.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.357 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.08 -143.67 4.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.916 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.44 ' HG3' HH11 ' A' ' 48' ' ' ARG . 51.2 mtm-85 -75.83 144.98 77.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.708 0.289 . . . . 0.0 111.495 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.901 ' HB3' ' HA ' ' A' ' 42' ' ' GLN . 19.5 Cg_endo -59.87 -175.9 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.749 2.299 . . . . 0.0 112.528 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.487 ' HB2' ' O ' ' A' ' 49' ' ' PRO . 4.3 m-85 66.62 154.75 0.09 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.657 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 53.75 53.21 11.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.278 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.43 -40.04 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.201 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.908 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.568 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.9 ttt -167.42 139.53 3.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.719 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.7 m -150.08 -146.13 0.19 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.562 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.455 ' N ' ' OE1' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -70.76 -28.53 64.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 0.0 110.98 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.5 pt-20 -57.13 -50.88 71.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.019 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 5.0 tp10 -66.99 -50.12 63.22 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.639 0.257 . . . . 0.0 111.291 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.691 HG13 HG22 ' A' ' 34' ' ' ILE . 61.1 t -53.35 -41.43 44.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.744 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 16.7 t80 -60.83 -39.13 87.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.586 HG22 HD21 ' A' ' 64' ' ' ASN . 85.8 m -70.94 -47.92 56.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.719 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 5.1 mm-40 -57.7 -46.96 83.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 58' ' ' VAL . 68.6 t -64.3 -41.26 91.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.911 0.386 . . . . 0.0 110.0 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.78 -39.96 93.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.105 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.586 HD21 HG22 ' A' ' 60' ' ' THR . 66.6 m-20 -60.48 -41.19 93.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.217 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CB ' ' A' ' 30' ' ' SER . 4.7 mt -66.75 -64.27 0.89 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.361 0.601 . . . . 0.0 110.669 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.451 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 8.6 m-30 -76.31 42.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.138 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -57.86 134.22 56.12 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.452 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.94 -41.44 2.39 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.257 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -79.52 59.95 3.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.901 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 48.5 mt-10 -61.51 -6.05 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.113 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.607 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 2.0 p30 -61.5 -44.32 97.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.74 0.305 . . . . 0.0 110.424 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.607 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 98.3 mt -72.62 -40.81 66.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.168 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 63' ' ' ALA . 1.0 OUTLIER -56.31 -35.83 68.0 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.206 179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 t -58.82 -39.94 82.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.468 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -70.57 -51.36 28.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.106 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.578 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 17.9 t80 -57.53 -39.6 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.133 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.48 -36.43 84.54 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.638 -0.71 . . . . 0.0 113.385 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.7 -45.93 77.75 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.915 0.357 . . . . 0.0 111.66 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -61.9 -47.9 82.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.995 0.426 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.784 HD21 HD11 ' B' ' 2' ' ' ILE . 25.2 mt -72.83 155.15 90.91 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.827 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.28 142.92 35.35 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.489 2.126 . . . . 0.0 111.86 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -46.36 -45.67 17.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.701 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -173.49 -137.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.981 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -149.14 -148.4 0.26 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.659 0.266 . . . . 0.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.012 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.76 0.314 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.844 HG23 HD22 ' A' ' 35' ' ' LEU . 41.2 mm -58.96 -37.69 68.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.785 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -54.65 -47.06 74.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.04 179.644 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 61.6 mtt -59.18 -49.5 77.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.981 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.686 HD23 ' HB1' ' A' ' 10' ' ' ALA . 87.5 mt -61.44 -48.06 82.88 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.938 0.399 . . . . 0.0 111.021 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' ' 35' ' ' LEU . 48.5 tp -61.5 -38.15 86.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 3' ' ' GLN . 4.1 tm-20 -67.18 -39.15 86.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.089 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.612 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -51.25 -43.58 61.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.786 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -57.08 -43.28 81.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -62.12 -40.61 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.644 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -59.09 -53.53 57.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.637 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.3 mt -64.62 -49.91 69.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.179 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.829 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.7 m 64.4 130.09 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.353 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -175.95 44.57 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.508 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.2 t -63.48 148.0 49.8 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.66 0.743 . . . . 0.0 112.52 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.587 ' HA ' ' ND2' ' A' ' 8' ' ' ASN . 71.0 t -56.35 -36.51 47.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.305 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -56.39 -38.0 70.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.089 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.584 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.4 t80 -65.42 -52.86 50.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.779 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.587 ' ND2' ' HA ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -65.22 -32.96 74.89 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.193 0.521 . . . . 0.0 110.32 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 2.6 t-20 -61.57 -41.01 96.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.543 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.99 -41.66 77.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.741 HD13 ' HB1' ' B' ' 8' ' ' ALA . 42.6 mm -54.8 -40.52 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.226 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.0 m -55.13 -39.66 69.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.452 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.667 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 17.0 t80 -68.73 -55.5 11.15 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.969 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.35 -37.26 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.938 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -64.03 -56.53 14.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.71 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.6 tttt -53.74 -40.12 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.504 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.667 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 79.1 mt -62.37 -45.74 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.625 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.632 ' HB2' ' HZ2' ' A' ' 18' ' ' LYS . 3.6 ttmp? -63.01 -55.87 21.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 16' ' ' LYS . 11.8 t -58.8 -32.59 69.49 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.472 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -68.31 -57.36 6.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.375 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -91.62 37.38 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.459 ' HG ' ' HA ' ' A' ' 19' ' ' THR . 43.6 mt -56.54 -33.2 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.847 0.356 . . . . 0.0 110.729 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -74.71 -36.95 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.657 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.421 ' HB3' HG12 ' A' ' 27' ' ' ILE . 93.7 m-70 -106.37 78.9 0.56 Allowed Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.797 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.44 -37.89 95.96 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.886 2.391 . . . . 0.0 112.677 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.95 -33.43 17.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.295 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.449 HG23 HD22 ' A' ' 65' ' ' LEU . 5.5 mm -64.49 -53.5 41.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.019 0.438 . . . . 0.0 110.814 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.623 ' CE2' HD11 ' A' ' 32' ' ' LEU . 45.1 t80 -60.5 -49.44 77.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.934 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.406 HH11 ' HG2' ' A' ' 29' ' ' ARG . 50.2 mmt-85 -52.67 -52.68 54.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.182 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 34' ' ' ILE . 61.9 m -53.83 -49.32 68.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.977 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.582 ' HA ' HD12 ' A' ' 34' ' ' ILE . 62.0 t80 -51.65 -50.29 60.64 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.926 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.623 HD11 ' CE2' ' A' ' 28' ' ' TYR . 36.1 mt -57.82 -44.73 86.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.117 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 95.2 mt-10 -62.68 -30.04 71.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.763 HG22 HG13 ' A' ' 58' ' ' VAL . 76.9 mt -60.95 -56.49 17.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.944 0.402 . . . . 0.0 110.241 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.857 ' HB2' HD13 ' B' ' 6' ' ' LEU . 49.5 mt -64.53 -41.72 96.19 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.621 0.724 . . . . 0.0 109.17 178.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.644 ' HB3' ' NZ ' ' A' ' 40' ' ' LYS . 11.8 m-70 -55.84 -41.61 74.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.954 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 70.1 m -59.74 -36.43 76.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.384 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.504 ' CE1' ' HA ' ' A' ' 54' ' ' SER . 62.0 t80 -60.84 -59.66 5.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.021 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.581 ' CD ' HD23 ' B' ' 6' ' ' LEU . 19.2 mt-30 -63.02 -36.6 84.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.096 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.644 ' NZ ' ' HB3' ' A' ' 36' ' ' HIS . 51.6 mttp -47.06 -35.51 6.98 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.85 -42.76 99.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.688 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.695 ' H ' HE21 ' A' ' 42' ' ' GLN . 0.1 OUTLIER -83.58 -50.2 8.46 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.64 13.18 0.39 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.622 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 95.8 m-70 -154.14 40.26 0.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.84 0.352 . . . . 0.0 111.171 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.6 p -62.59 134.14 55.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.829 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HD2' ' HA ' ' A' ' 46' ' ' LYS . 14.6 tptm -172.55 -50.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.058 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.31 33.49 0.04 OUTLIER Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.453 -0.88 . . . . 0.0 112.978 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.473 ' HG3' HH11 ' A' ' 48' ' ' ARG . 52.6 mtt85 -75.52 142.1 73.84 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.661 0.267 . . . . 0.0 111.009 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.432 ' HB2' ' HG3' ' A' ' 51' ' ' ARG . 14.6 Cg_endo -57.09 129.77 36.12 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.618 2.212 . . . . 0.0 112.345 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.441 ' C ' ' H ' ' A' ' 52' ' ' GLY . 4.6 m-85 -81.25 52.83 1.9 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.403 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HG3' ' HB2' ' A' ' 49' ' ' PRO . 89.0 mtm180 -76.86 31.19 0.13 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.227 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . 65.03 135.89 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 115.946 -0.57 . . . . 0.0 113.182 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.5 tpt -169.0 126.82 0.99 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 120.837 0.351 . . . . 0.0 110.879 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.504 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.1 t -176.95 -138.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.129 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -33.82 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.026 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 22.5 pt-20 -59.85 -51.34 70.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.448 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 39.4 tp10 -67.84 -52.07 41.12 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.162 -0.215 . . . . 0.0 111.405 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.763 HG13 HG22 ' A' ' 34' ' ' ILE . 88.8 t -53.4 -42.56 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.061 -179.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.611 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 23.4 t80 -63.6 -38.94 93.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.616 HG22 HD21 ' A' ' 64' ' ' ASN . 89.6 m -68.47 -48.72 63.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.838 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.448 ' OE1' HG23 ' A' ' 34' ' ' ILE . 93.0 mt-10 -57.28 -45.87 83.65 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.825 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 58' ' ' VAL . 64.8 t -64.58 -40.78 90.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.785 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.85 -39.89 90.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.039 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.616 HD21 HG22 ' A' ' 60' ' ' THR . 73.2 m-20 -64.44 -41.04 96.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.661 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 30' ' ' SER . 5.3 mt -64.04 -64.16 0.96 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.268 0.556 . . . . 0.0 111.298 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.611 ' HB2' HD23 ' A' ' 73' ' ' LEU . 6.2 m-30 -74.48 40.25 0.13 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.768 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -59.0 131.57 51.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 110.296 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.23 -43.38 2.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.966 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -86.03 52.62 2.53 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.937 0.399 . . . . 0.0 110.525 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.594 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 94.9 mt-10 -64.6 0.88 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.013 -179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -61.49 -47.98 83.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.077 0.465 . . . . 0.0 109.96 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.06 -33.64 68.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.966 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.74 -43.23 68.93 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.676 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 38.8 t -54.36 -40.49 68.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.696 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 49.4 mt-10 -63.35 -46.32 87.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.451 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 13.4 t80 -57.72 -44.68 86.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.54 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.73 -29.64 72.69 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.047 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 74' ' ' SER . 11.5 mm100 -47.73 -51.19 23.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.737 0.303 . . . . 0.0 111.483 -179.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -69.16 -43.16 74.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.753 HD21 HD11 ' B' ' 2' ' ' ILE . 53.1 mt -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.049 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 13.8 Cg_exo -68.02 123.71 10.96 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.471 2.114 . . . . 0.0 111.82 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 81' ' ' PRO . 88.5 tt0 178.74 64.12 0.01 OUTLIER 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.876 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.34 -44.88 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.434 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -59.59 -41.14 89.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.024 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.742 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 5.0 m120 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.921 0.391 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.759 HG23 HD22 ' A' ' 35' ' ' LEU . 40.2 mm -61.27 -39.87 84.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.165 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -35.05 62.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.655 0.264 . . . . 0.0 110.61 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 95.8 mmm -69.42 -45.82 68.27 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.649 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' B' ' 8' ' ' ALA . 20.2 tp -64.03 -49.2 73.33 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.936 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 35' ' ' LEU . 28.5 tp -59.86 -40.39 88.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.022 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -63.88 -37.3 86.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.741 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.6 -41.5 70.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.923 179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.49 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -56.87 -46.22 81.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.72 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -59.03 -38.44 79.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.176 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.411 ' C ' ' H ' ' B' ' 13' ' ' GLU . 66.6 t80 -63.42 -44.47 94.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 11' ' ' ILE . 84.6 mt -75.86 24.7 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.715 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' B' ' 11' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.183 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.836 0.35 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -62.43 -48.86 77.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.052 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -175.2 42.43 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.998 0.428 . . . . 0.0 110.632 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -62.79 143.62 57.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.128 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.527 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 99.1 t -60.69 -39.58 82.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.051 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 47.6 mt-10 -54.13 -34.88 61.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.12 0.486 . . . . 0.0 109.783 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.575 ' O ' HG12 ' A' ' 11' ' ' ILE . 15.2 t80 -68.41 -56.04 9.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.981 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -62.86 -28.4 70.0 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.917 0.865 . . . . 0.0 108.953 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.527 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.1 t-20 -58.66 -46.05 88.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.041 -1.436 . . . . 0.0 109.683 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -71.19 -36.94 72.12 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.318 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.591 HD13 ' HB1' ' B' ' 8' ' ' ALA . 49.4 mm -52.57 -41.89 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.92 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.0 t -58.7 -37.64 76.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.191 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.632 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -63.26 -54.15 41.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.25 0.547 . . . . 0.0 109.741 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.468 HG11 ' HA ' ' B' ' 9' ' ' ALA . 53.1 t -60.36 -38.94 79.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.85 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -63.6 -47.28 82.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.391 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.521 ' HA ' HG22 ' A' ' 19' ' ' THR . 23.5 ttmm -63.28 -36.14 82.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.592 HG12 HD13 ' A' ' 72' ' ' LEU . 81.2 mt -64.66 -42.55 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.823 0.344 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 28.7 mtpp -62.29 -46.6 88.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.127 0.489 . . . . 0.0 110.783 179.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.522 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -71.27 -29.45 65.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.529 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -67.14 -56.02 11.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.547 ' CD2' HG13 ' A' ' 27' ' ' ILE . 73.1 m-85 -95.48 42.09 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 19' ' ' THR . 77.9 mt -54.97 -36.6 65.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.331 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -75.66 -38.47 58.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.885 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -105.86 78.15 0.45 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.198 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.45 -33.65 93.8 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.75 2.3 . . . . 0.0 112.518 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -53.51 -30.21 40.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.547 HG13 ' CD2' ' A' ' 21' ' ' PHE . 6.9 mm -64.19 -51.95 62.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.837 0.351 . . . . 0.0 111.017 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.622 ' CE2' HD11 ' A' ' 32' ' ' LEU . 62.7 t80 -57.08 -46.1 82.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.823 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.503 ' HA ' HH11 ' A' ' 29' ' ' ARG . 3.8 mmm180 -55.68 -56.11 24.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.618 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.661 ' HB2' HD11 ' A' ' 65' ' ' LEU . 50.9 m -54.64 -49.88 69.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.21 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -49.15 -47.11 45.98 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.027 0.442 . . . . 0.0 110.825 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.622 HD11 ' CE2' ' A' ' 28' ' ' TYR . 90.0 mt -60.09 -40.69 90.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.555 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -63.4 -36.81 84.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.48 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.526 HG21 HG23 ' A' ' 62' ' ' VAL . 75.3 mt -60.07 -56.32 18.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.749 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.686 HD22 HG23 ' B' ' 2' ' ' ILE . 83.4 mt -59.02 -44.41 91.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.326 0.584 . . . . 0.0 109.468 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.581 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -54.96 -42.68 72.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.708 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.636 HG22 ' SD ' ' A' ' 53' ' ' MET . 98.8 m -55.66 -39.04 70.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.619 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' HB2' ' CG2' ' A' ' 58' ' ' VAL . 42.2 t80 -65.25 -57.19 9.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.951 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.571 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 3.8 mm100 -52.45 -34.48 48.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.727 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.813 ' HA ' ' HE3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -53.3 -49.88 66.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.266 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -42.66 83.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.332 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.594 ' O ' HG23 ' A' ' 45' ' ' THR . 8.2 tt0 -57.93 -33.38 68.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.54 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.7 mt -56.02 -47.18 78.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.777 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -116.26 53.6 0.86 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.648 -179.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.594 HG23 ' O ' ' A' ' 42' ' ' GLN . 57.8 p -60.41 132.4 53.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.821 0.343 . . . . 0.0 111.349 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.543 ' N ' ' HD2' ' A' ' 46' ' ' LYS . 11.8 mptt -81.11 46.1 0.89 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.721 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.46 -96.88 0.36 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.604 -0.808 . . . . 0.0 112.169 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -59.76 143.61 86.77 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.759 0.314 . . . . 0.0 110.789 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.42 136.32 70.94 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.814 2.343 . . . . 0.0 112.513 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -119.94 144.17 47.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.791 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HG3' HH11 ' A' ' 51' ' ' ARG . 53.2 mtm-85 -76.34 35.1 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.882 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.94 -46.36 7.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.425 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.636 ' SD ' HG22 ' A' ' 37' ' ' THR . 26.5 ttt -168.96 147.36 3.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.3 -0.45 . . . . 0.0 110.685 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 58' ' ' VAL . 18.7 t -162.54 -154.57 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.542 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -62.97 -31.38 72.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.729 0.3 . . . . 0.0 111.076 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.2 pt-20 -61.3 -51.15 70.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.734 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 18.4 tt0 -69.04 -45.34 70.67 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.364 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.616 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.5 t -56.91 -44.14 81.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.113 0.482 . . . . 0.0 110.375 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.7 t80 -64.24 -37.93 89.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.724 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.9 m -65.47 -55.27 18.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.11 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' HB2' ' CG2' ' A' ' 34' ' ' ILE . 59.3 mm-40 -57.54 -46.5 83.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.526 HG23 HG21 ' A' ' 34' ' ' ILE . 85.8 t -64.0 -41.35 92.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.912 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.9 -41.09 95.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.14 0.495 . . . . 0.0 109.931 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -60.08 -44.56 94.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.553 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.661 HD11 ' HB2' ' A' ' 30' ' ' SER . 3.1 mt -63.17 -61.56 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.334 0.588 . . . . 0.0 110.605 179.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.425 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 6.4 m-30 -72.94 36.94 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.486 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 65' ' ' LEU . 29.5 tpt85 -59.6 129.46 42.03 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -36.14 2.13 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.371 -0.918 . . . . 0.0 111.553 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -78.28 42.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.836 0.35 . . . . 0.0 110.17 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.677 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 6.3 tt0 -53.99 -11.68 0.48 Allowed 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -60.69 -49.4 77.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.87 0.367 . . . . 0.0 110.074 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 17' ' ' ILE . 82.3 mt -72.49 -34.38 67.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.541 . . . . 0.0 110.058 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.912 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -52.04 -42.32 63.02 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.107 -179.652 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 t -56.87 -41.13 77.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.257 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.718 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 90.7 mt-10 -67.99 -46.63 70.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.034 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 19.4 t80 -58.35 -41.48 84.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.1 -42.79 99.91 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.421 -0.809 . . . . 0.0 114.069 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.718 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 1.6 pt20 -54.87 -40.93 70.23 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 117.238 0.519 . . . . 0.0 111.211 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -62.17 -46.71 87.74 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 120.991 0.424 . . . . 0.0 110.411 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 73.7 mt -62.93 148.16 92.71 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.657 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.1 143.09 42.68 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.518 2.145 . . . . 0.0 112.128 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -157.0 64.52 0.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.92 0.391 . . . . 0.0 110.991 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 65.11 51.78 1.61 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.5 tttm 64.83 134.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.101 0.477 . . . . 0.0 111.801 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.503 HH11 ' HG3' ' A' ' 85' ' ' ARG . 28.7 tpt85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.757 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.937 0.398 . . . . 0.0 111.304 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.686 HG23 HD22 ' A' ' 35' ' ' LEU . 51.4 mm -65.59 -39.53 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . 0.401 ' HB3' HE21 ' B' ' 3' ' ' GLN . 0.0 OUTLIER -57.41 -33.85 68.31 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.573 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.1 mmt -59.15 -39.44 82.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.473 HD23 ' HB1' ' A' ' 10' ' ' ALA . 35.1 mt -72.14 -45.77 59.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.548 ' HG ' ' HG3' ' A' ' 39' ' ' GLN . 3.3 mm? -56.8 -42.72 80.01 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.453 0.645 . . . . 0.0 109.265 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -70.93 -37.19 72.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.154 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.591 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -62.65 -47.19 84.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.03 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.468 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.86 -43.21 76.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.321 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.64 -38.96 89.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.715 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.47 ' HD2' HD12 ' A' ' 11' ' ' ILE . 37.1 t80 -62.23 -54.95 33.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.746 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.413 HD21 ' CG2' ' A' ' 11' ' ' ILE . 95.5 mt -62.41 -51.33 67.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.627 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.909 -179.92 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.724 0.297 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m 56.31 44.15 25.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.789 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -173.78 50.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.467 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p -56.65 147.5 22.43 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.441 0.639 . . . . 0.0 112.106 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.592 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 69.7 t -55.33 -39.34 51.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.081 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 53.0 mt-10 -59.45 -38.6 81.18 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.139 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.475 ' O ' HG12 ' A' ' 11' ' ' ILE . 20.6 t80 -60.76 -58.22 9.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.429 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -64.29 -28.83 69.99 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.592 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.2 t-20 -58.13 -44.06 87.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.347 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.21 -45.43 60.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.188 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.622 HD13 ' HB1' ' B' ' 8' ' ' ALA . 40.3 mm -53.35 -45.48 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.261 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -58.29 -35.37 71.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.114 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 38.7 t80 -63.35 -55.83 21.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.195 0.521 . . . . 0.0 109.815 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' B' ' 8' ' ' ALA . 36.9 t -60.73 -38.02 77.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.453 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.57 -41.08 96.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.691 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' HA ' HG22 ' A' ' 19' ' ' THR . 40.4 ttmt -66.77 -38.72 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.125 0.488 . . . . 0.0 110.121 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.516 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 84.8 mt -62.11 -42.83 96.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.68 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -65.28 -54.78 24.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.641 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.6 t -59.64 -31.27 69.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.569 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -68.11 -52.42 35.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.115 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.616 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 78.2 m-85 -98.3 44.17 1.04 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.026 -179.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 85.2 mt -56.39 -42.41 77.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.854 0.359 . . . . 0.0 110.546 179.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -76.21 -23.72 54.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.157 0.503 . . . . 0.0 109.86 179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.616 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 47.3 m170 -108.99 73.06 0.5 Allowed Pre-proline 0 CA--C 1.535 0.366 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.351 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.39 -34.59 43.2 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.639 2.226 . . . . 0.0 112.46 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -53.91 -35.25 61.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.427 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.607 ' CG1' ' HB3' ' A' ' 24' ' ' HIS . 1.0 OUTLIER -64.29 -51.65 65.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.556 -179.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE2' HD11 ' A' ' 32' ' ' LEU . 54.9 t80 -56.9 -47.24 81.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.95 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -55.61 -54.6 42.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.277 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.554 ' O ' HG13 ' A' ' 34' ' ' ILE . 44.7 t -54.16 -48.12 71.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.606 ' HA ' HD12 ' A' ' 34' ' ' ILE . 49.0 t80 -52.33 -47.52 65.98 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.99 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' CE2' ' A' ' 28' ' ' TYR . 66.4 mt -60.09 -41.42 92.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 39.3 tt0 -63.77 -30.02 71.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.689 HG22 HG13 ' A' ' 58' ' ' VAL . 79.6 mt -62.47 -56.71 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.124 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.052 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.749 HD22 HG23 ' B' ' 2' ' ' ILE . 78.3 mt -61.82 -36.26 80.64 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.5 0.667 . . . . 0.0 109.232 178.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.586 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 5.1 m-70 -59.95 -48.06 83.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.901 179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.563 HG22 ' SD ' ' A' ' 53' ' ' MET . 99.5 m -60.49 -36.59 78.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.239 179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.586 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 41.5 t80 -53.95 -57.76 9.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.568 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.6 mm100 -60.9 -42.55 98.24 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.091 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 34.5 mmtp -53.86 -44.48 70.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.367 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG2' ' HB3' ' A' ' 53' ' ' MET . 5.6 tp10 -69.66 -35.99 75.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.649 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.38 -31.42 70.78 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 88.4 mt -71.81 121.97 19.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.415 ' HB3' ' O ' ' A' ' 43' ' ' LEU . 21.3 p80 168.3 135.2 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.262 0.351 . . . . 0.0 111.124 179.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.8 p -118.51 132.79 56.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.697 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 60.23 123.16 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.49 145.15 4.08 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.575 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.39 133.77 62.05 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.533 0.206 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -63.96 148.99 91.51 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.597 2.198 . . . . 0.0 112.297 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.6 166.83 23.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.304 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -45.53 -33.17 2.6 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.214 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 55.89 -132.4 50.32 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.979 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.563 ' SD ' HG22 ' A' ' 37' ' ' THR . 25.2 ttt -167.03 144.51 4.75 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.618 -0.291 . . . . 0.0 110.809 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.505 ' O ' HG23 ' A' ' 58' ' ' VAL . 75.6 m -157.81 -145.76 0.15 Allowed 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.231 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.833 ' HG2' ' HD2' ' A' ' 81' ' ' PRO . 9.1 mp0 -60.22 -33.52 72.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.752 0.31 . . . . 0.0 110.999 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -54.04 -44.42 71.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.338 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.467 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 37.2 tp10 -82.21 -51.89 7.5 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.689 HG13 HG22 ' A' ' 34' ' ' ILE . 44.6 t -52.94 -43.11 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.639 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.558 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 40.2 t80 -61.15 -36.88 80.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.875 0.369 . . . . 0.0 110.302 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.63 HG22 HD21 ' A' ' 64' ' ' ASN . 88.1 m -71.79 -48.39 46.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.475 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -56.78 -48.07 78.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.932 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.3 t -64.56 -41.85 93.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.068 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.663 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.7 -39.03 83.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.85 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.63 HD21 HG22 ' A' ' 60' ' ' THR . 70.3 m-20 -63.91 -37.98 89.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.347 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 30' ' ' SER . 5.8 mt -70.56 -66.28 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.512 179.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.561 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.0 m-30 -74.55 38.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.087 -178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -66.4 138.49 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.549 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.31 -44.53 2.79 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.527 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.523 ' C ' ' H ' ' A' ' 71' ' ' ASP . 0.7 OUTLIER -68.47 -62.95 1.17 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.82 0.343 . . . . 0.0 110.573 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 52.6 mt-10 59.98 -15.94 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.523 ' H ' ' C ' ' A' ' 69' ' ' GLN . 34.4 t70 -61.99 -49.17 77.15 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-O 121.096 0.474 . . . . 0.0 109.897 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.3 mt -68.84 -36.35 78.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.834 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.664 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -54.59 -39.35 67.74 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.68 179.858 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.591 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 37.4 t -55.44 -41.96 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.738 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.66 -42.77 77.44 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.539 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.626 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 20.1 t80 -57.28 -44.22 83.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.846 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.02 -38.36 95.41 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.59 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 74' ' ' SER . 76.8 mt-30 -54.71 -45.3 74.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.885 0.374 . . . . 0.0 110.906 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -66.85 -44.53 80.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.003 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.62 HD21 HD11 ' B' ' 2' ' ' ILE . 85.8 mt -65.48 131.75 94.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.378 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.833 ' HD2' ' HG2' ' A' ' 55' ' ' GLU . 16.2 Cg_exo -66.87 147.78 81.19 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.806 2.338 . . . . 0.0 111.786 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -64.83 -151.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.222 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -177.06 44.87 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.81 0.338 . . . . 0.0 111.196 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -62.08 139.34 58.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.459 ' HD2' ' C ' ' A' ' 85' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.2 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 6.4 m120 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.648 0.261 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.749 HG23 HD22 ' A' ' 35' ' ' LEU . 48.1 mm -52.73 -24.56 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.141 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -55.4 -58.13 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.485 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -79.77 -27.99 40.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' B' ' 2' ' ' ILE . 0.9 OUTLIER -58.87 -45.95 88.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.845 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.729 HD13 ' HB2' ' A' ' 35' ' ' LEU . 43.1 tp -77.77 -44.46 27.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.314 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 tp10 -56.52 -33.16 65.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.653 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.622 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.71 -41.95 82.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.357 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.48 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -56.47 -47.68 78.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.442 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.98 -38.88 83.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -59.53 -54.77 42.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.849 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.87 -48.83 80.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.903 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 12.5 pt-20 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.787 0.327 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p -177.26 -146.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.373 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 63.45 148.51 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.895 0.379 . . . . 0.0 111.482 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -51.17 144.1 9.85 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.123 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.553 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 92.9 t -58.67 -40.71 80.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.386 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.463 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 91.7 mt-10 -58.23 -38.96 77.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.585 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.48 ' O ' HG12 ' A' ' 11' ' ' ILE . 13.4 t80 -59.92 -56.58 20.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.747 0.308 . . . . 0.0 110.702 -179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.06 -31.07 72.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.563 0.696 . . . . 0.0 109.153 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.553 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 35.4 t-20 -56.88 -43.15 81.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.661 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.723 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -69.56 -39.79 77.2 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.278 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.506 HD13 ' CB ' ' B' ' 8' ' ' ALA . 42.4 mm -53.79 -42.76 53.7 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.198 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.416 179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 m -55.58 -37.97 68.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.823 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.553 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.9 t80 -64.84 -58.08 7.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.847 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.541 HG21 ' HB3' ' B' ' 8' ' ' ALA . 48.6 t -58.88 -45.09 91.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.396 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -61.07 -54.58 42.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.042 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.455 ' HA ' HG22 ' A' ' 19' ' ' THR . 87.8 tttt -53.64 -37.42 63.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.197 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.607 HG12 HD13 ' A' ' 72' ' ' LEU . 95.5 mt -64.84 -37.26 79.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.002 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -65.54 -47.59 75.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.426 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.3 t -70.98 -26.99 63.39 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.754 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HG2' HD11 ' A' ' 72' ' ' LEU . 19.5 tpp180 -64.77 -58.07 7.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.318 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.794 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 61.6 m-85 -94.89 46.42 1.13 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.427 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.5 mt -55.45 -40.74 71.96 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.811 0.338 . . . . 0.0 110.796 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.38 -19.35 46.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.094 0.473 . . . . 0.0 110.156 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.794 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 58.1 m170 -110.33 74.06 0.82 Allowed Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.354 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.72 -35.61 56.7 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.589 2.193 . . . . 0.0 112.55 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -52.17 -36.47 51.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.639 HG13 ' CD2' ' A' ' 21' ' ' PHE . 1.0 OUTLIER -64.46 -48.35 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 110.701 -179.738 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.619 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 55.3 t80 -56.92 -51.36 69.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.118 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 29' ' ' ARG . 21.5 mmt85 -56.9 -54.29 48.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.493 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.595 ' O ' HG13 ' A' ' 34' ' ' ILE . 57.0 m -52.85 -49.56 65.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.626 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.9 t80 -53.54 -49.81 66.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 110.959 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.633 HD22 ' HB2' ' B' ' 9' ' ' ALA . 41.2 mt -58.1 -39.78 79.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.161 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.59 -29.53 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.201 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.685 HD11 HD12 ' A' ' 65' ' ' LEU . 82.9 mt -61.75 -59.53 4.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.57 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.801 HD22 HG23 ' B' ' 2' ' ' ILE . 86.3 mt -60.3 -38.79 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.661 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 1.1 m-70 -59.74 -42.79 93.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.242 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.401 ' HA ' ' HD2' ' A' ' 40' ' ' LYS . 75.3 m -60.53 -39.12 86.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.371 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.481 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 46.6 t80 -55.16 -58.87 5.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.667 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.544 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 11.0 mm100 -55.27 -38.5 68.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.046 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 67.2 mttm -47.3 -42.85 21.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.792 0.329 . . . . 0.0 111.101 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -70.73 -45.72 64.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.106 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.698 ' H ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER -77.75 18.61 0.45 Allowed 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -179.367 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 71.5 mt -77.76 30.1 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.831 0.348 . . . . 0.0 111.183 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.432 ' H ' ' C ' ' A' ' 42' ' ' GLN . 56.1 m170 -128.15 -128.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.814 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.8 p -145.26 39.31 1.19 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -152.36 145.57 24.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.625 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -149.43 34.07 1.08 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.24 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -80.74 147.44 62.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.672 0.272 . . . . 0.0 110.668 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -56.45 132.09 49.69 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.651 2.234 . . . . 0.0 111.737 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.447 ' C ' ' H ' ' A' ' 52' ' ' GLY . 2.7 t80 -172.52 -166.73 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.284 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.418 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 54.3 ttp180 -71.25 10.58 0.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.148 0.499 . . . . 0.0 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.447 ' H ' ' C ' ' A' ' 50' ' ' PHE . . . -75.38 -126.42 0.19 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.656 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.3 ttt -156.93 149.16 23.05 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.534 -0.333 . . . . 0.0 111.087 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.465 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 81.3 p -164.93 -142.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.275 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.83 -30.69 71.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.892 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.5 pt-20 -54.8 -50.18 69.17 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 5.0 tp10 -72.9 -49.44 29.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.581 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 57.8 t -52.63 -40.68 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.396 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.49 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 22.5 t80 -60.38 -40.22 90.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.561 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.3 m -73.59 -44.8 56.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.407 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.663 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -57.29 -47.77 80.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.232 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.66 -42.93 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.947 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -62.21 -44.81 95.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.134 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.663 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -64.12 -40.87 97.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.87 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.685 HD12 HD11 ' A' ' 34' ' ' ILE . 3.2 mt -60.98 -61.0 2.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.829 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.461 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 6.6 m-30 -72.95 38.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.826 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 46.2 ttm-85 -60.2 127.88 34.01 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.49 -43.23 2.78 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.802 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.43 49.84 1.88 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-O 120.94 0.4 . . . . 0.0 110.453 179.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 50.8 mt-10 -60.63 -8.52 2.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.732 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -61.16 -45.68 93.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.93 0.395 . . . . 0.0 109.942 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.607 HD13 HG12 ' A' ' 17' ' ' ILE . 94.4 mt -72.15 -32.63 67.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.919 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.947 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -55.28 -42.53 73.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.738 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.49 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 44.3 t -53.79 -39.94 65.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.234 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -68.0 -41.53 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.608 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 12.4 t80 -56.54 -43.55 79.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.246 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.13 -32.87 83.95 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.26 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 74' ' ' SER . 94.0 mm-40 -56.39 -47.31 79.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.858 0.361 . . . . 0.0 111.001 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.409 ' HB3' ' OD1' ' B' ' 1' ' ' ASN . 3.0 m-85 -70.35 -44.55 67.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.169 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 76' ' ' PHE . 93.7 mt -57.08 126.46 73.45 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.978 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.32 129.69 17.43 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.538 2.159 . . . . 0.0 112.356 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -70.82 132.95 46.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.4 -166.65 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 61.74 134.89 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.421 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.483 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 9.0 mpt_? . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.757 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.409 ' OD1' ' HB3' ' A' ' 79' ' ' PHE . 23.8 t-20 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.903 0.382 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.801 HG23 HD22 ' A' ' 35' ' ' LEU . 37.7 mm -64.4 -34.45 69.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.785 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.64 -35.13 40.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.233 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 24.9 mmt -63.14 -50.39 70.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.591 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.723 HD23 ' HB1' ' A' ' 10' ' ' ALA . 81.9 mt -65.95 -46.91 76.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.37 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' ' 35' ' ' LEU . 41.4 tp -61.17 -47.22 87.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.007 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -63.27 -35.51 80.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.418 . . . . 0.0 110.184 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.541 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -52.98 -38.57 62.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.917 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.633 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -57.66 -48.27 79.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.134 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.6 -38.73 91.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.629 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -57.94 -54.24 49.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.55 -49.55 70.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.221 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.889 179.851 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.567 0.222 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.6 m 54.94 44.91 27.52 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.798 0.332 . . . . 0.0 111.041 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 58.17 54.83 5.53 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.741 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 m -51.76 142.49 14.81 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.262 0.553 . . . . 0.0 111.366 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.535 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 92.0 t -60.65 -41.92 89.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.549 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 89.4 mt-10 -57.76 -38.47 75.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.642 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.525 ' O ' HG12 ' A' ' 11' ' ' ILE . 17.0 t80 -59.98 -57.43 12.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.889 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -31.28 72.33 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.569 0.699 . . . . 0.0 109.374 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.535 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.5 t-20 -55.66 -42.94 75.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.552 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.21 -44.42 62.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.981 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.742 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.6 mm -53.15 -43.06 48.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.046 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -57.15 -38.47 73.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.028 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.592 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 25.1 t80 -63.88 -55.97 18.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.088 0.47 . . . . 0.0 110.768 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.9 t -57.1 -45.0 84.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.378 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -57.69 -56.32 23.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.111 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.2 tttt -52.99 -36.53 60.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.518 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.592 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 76.9 mt -64.19 -41.12 91.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.268 179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -64.17 -55.48 21.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.507 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 13.3 t -59.22 -31.18 68.81 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.396 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH2' ' HG3' ' A' ' 69' ' ' GLN . 10.8 tpt180 -68.11 -56.09 10.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.909 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 27' ' ' ILE . 55.8 m-85 -93.98 41.31 1.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.989 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.0 mt -56.96 -35.36 69.03 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.996 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -74.95 -39.95 61.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.021 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -107.74 77.24 0.61 Allowed Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.356 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.99 -33.74 95.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.593 2.195 . . . . 0.0 112.395 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -51.2 -34.11 30.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.882 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.491 HG21 ' CE2' ' A' ' 21' ' ' PHE . 3.8 mm -64.37 -45.99 94.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.167 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 59.8 t80 -58.82 -49.39 77.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -56.24 -55.49 32.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.466 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.553 ' O ' HG13 ' A' ' 34' ' ' ILE . 18.5 p -53.02 -49.01 67.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.325 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.557 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.8 t80 -51.2 -45.25 61.78 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.878 0.37 . . . . 0.0 110.435 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 64.9 mt -62.93 -49.51 74.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -53.65 -29.39 38.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.481 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.696 HG22 HG13 ' A' ' 58' ' ' VAL . 84.3 mt -61.26 -49.62 83.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.104 0.478 . . . . 0.0 110.135 179.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.762 HD22 HG23 ' B' ' 2' ' ' ILE . 58.2 mt -66.15 -40.97 90.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.594 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 0.8 OUTLIER -60.26 -38.86 84.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.21 178.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.655 HG22 ' SD ' ' A' ' 53' ' ' MET . 87.1 m -60.94 -36.84 80.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.621 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.641 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 78.5 t80 -59.07 -60.3 4.09 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.012 179.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' OE1' ' HD2' ' A' ' 38' ' ' TYR . 2.7 mp0 -52.41 -31.75 35.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 48.4 mmtm -59.69 -75.7 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -81.98 38.04 0.51 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.639 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.525 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 3.0 pt20 -67.27 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.783 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.525 ' N ' ' HG3' ' A' ' 42' ' ' GLN . 0.2 OUTLIER -62.19 -120.26 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.586 -179.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.434 ' H ' ' HB2' ' A' ' 43' ' ' LEU . 24.6 m170 71.41 38.96 0.97 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.432 0.634 . . . . 0.0 109.898 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 p 48.23 -150.28 0.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.681 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 46' ' ' LYS . 12.3 mptt -96.49 151.24 19.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.134 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -159.59 -131.04 1.2 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.424 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.409 HH11 ' HG2' ' A' ' 48' ' ' ARG . 73.2 mtt-85 -56.13 141.95 67.56 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.711 0.291 . . . . 0.0 110.984 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.97 134.1 60.11 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.681 2.254 . . . . 0.0 112.295 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -173.9 147.72 1.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.647 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.514 ' NE ' ' HA ' ' A' ' 51' ' ' ARG . 5.8 tpm_? -58.28 -9.27 1.43 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.145 0.498 . . . . 0.0 111.151 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.0 135.1 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.75 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.655 ' SD ' HG22 ' A' ' 37' ' ' THR . 27.1 ttt -101.06 149.09 24.31 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.418 -0.391 . . . . 0.0 111.164 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.641 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 79.8 p -163.09 -148.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.732 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -68.51 -32.62 72.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.035 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.457 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 11.6 pt-20 -61.78 -48.11 82.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.581 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 68.5 tt0 -66.85 -47.66 71.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.595 0.236 . . . . 0.0 111.196 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.696 HG13 HG22 ' A' ' 34' ' ' ILE . 66.9 t -57.96 -43.15 84.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.984 0.421 . . . . 0.0 110.513 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.635 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.3 t80 -62.86 -39.44 94.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.944 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.588 HG22 HD21 ' A' ' 64' ' ' ASN . 85.1 m -66.14 -49.67 66.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -57.33 -45.29 84.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.016 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 58' ' ' VAL . 80.7 t -64.48 -40.83 90.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.054 179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.89 -41.66 98.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.098 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.588 HD21 HG22 ' A' ' 60' ' ' THR . 74.1 m-20 -62.01 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.532 179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.604 HD12 HD11 ' A' ' 34' ' ' ILE . 5.8 mt -67.64 -65.06 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.431 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.525 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 5.9 m-30 -73.43 38.86 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.638 -179.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -58.76 132.62 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.23 -43.32 3.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.791 -178.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.8 OUTLIER -79.93 51.23 1.3 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.81 0.338 . . . . 0.0 110.587 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.1 mt-10 -61.72 -4.33 1.42 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.051 -179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -61.72 -50.61 71.75 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.964 0.411 . . . . 0.0 110.066 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.58 -36.28 73.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.981 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.92 -40.85 70.29 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.64 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.9 t -56.3 -40.35 74.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.562 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.29 -38.91 71.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.088 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.635 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.6 t80 -57.51 -43.24 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.005 0.431 . . . . 0.0 110.233 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.21 -31.41 78.96 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.364 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -50.63 -48.53 58.05 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.801 0.334 . . . . 0.0 111.018 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -69.86 -43.26 72.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.556 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 75.5 mt -61.07 131.52 91.97 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.739 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 Cg_exo -68.92 -171.19 0.38 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.466 2.111 . . . . 0.0 112.087 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.446 ' HB3' ' O ' ' A' ' 81' ' ' PRO . 39.1 tt0 72.44 -39.9 0.46 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.943 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.63 -147.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.652 0.263 . . . . 0.0 111.398 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp 63.59 134.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.998 0.428 . . . . 0.0 111.156 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.801 179.995 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.762 HG23 HD22 ' A' ' 35' ' ' LEU . 40.6 mm -62.88 -39.33 84.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -34.34 64.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.511 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 45.8 ttm -63.26 -49.92 72.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.256 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.552 HD23 ' HB1' ' A' ' 10' ' ' ALA . 68.6 mt -68.46 -46.72 69.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.955 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.462 HD13 ' HB2' ' A' ' 35' ' ' LEU . 63.0 tp -56.85 -44.46 82.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.556 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -68.27 -39.58 82.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.615 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.742 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.67 -40.49 79.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.15 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.438 ' CB ' HD22 ' A' ' 32' ' ' LEU . . . -61.9 -40.65 96.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.279 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -64.01 -44.22 93.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.793 0.33 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -64.05 -58.67 5.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.473 0.654 . . . . 0.0 110.776 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.414 HD13 HG23 ' A' ' 11' ' ' ILE . 21.2 tp -57.95 -36.97 73.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.43 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.922 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.548 0.213 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 82.5 p -173.49 132.76 0.47 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.839 0.352 . . . . 0.0 110.863 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -70.77 -133.47 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.004 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -58.39 141.6 50.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.179 0.514 . . . . 0.0 111.257 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 82.8 t -62.69 -42.27 95.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.494 179.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 47.3 mt-10 -56.4 -37.76 70.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.611 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.561 ' O ' HG12 ' A' ' 11' ' ' ILE . 22.1 t80 -60.01 -57.71 11.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.882 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.59 -33.27 75.53 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.645 0.735 . . . . 0.0 109.321 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 38.5 t-20 -54.45 -43.83 71.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.891 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.57 -41.5 65.66 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.242 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.744 HD13 ' HB1' ' B' ' 8' ' ' ALA . 47.0 mm -51.75 -47.15 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.373 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -55.54 -36.61 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.183 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.577 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 26.5 t80 -62.46 -54.27 42.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.191 0.519 . . . . 0.0 109.68 179.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' B' ' 9' ' ' ALA . 61.2 t -57.75 -40.12 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.542 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.64 -53.03 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.437 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 61.3 tttp -58.14 -36.72 73.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.937 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 13' ' ' TYR . 89.1 mt -61.43 -38.47 80.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.987 0.422 . . . . 0.0 110.286 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 14' ' ' VAL . 29.6 mtpp -64.55 -45.22 88.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.255 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.605 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.7 t -74.83 -28.66 60.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.909 -179.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.51 -56.47 15.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.974 0.416 . . . . 0.0 111.143 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.663 ' CD2' HG13 ' A' ' 27' ' ' ILE . 50.6 m-85 -97.11 48.21 1.05 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 19' ' ' THR . 73.3 mt -52.71 -40.46 63.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.692 0.282 . . . . 0.0 111.111 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -77.31 -27.32 52.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.189 0.519 . . . . 0.0 110.036 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 21' ' ' PHE . 63.6 m170 -109.76 73.41 0.66 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.735 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -65.82 -32.71 45.62 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.311 2.007 . . . . 0.0 112.126 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -54.91 -32.09 60.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.512 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.663 HG13 ' CD2' ' A' ' 21' ' ' PHE . 2.4 mm -63.81 -48.53 85.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.958 0.409 . . . . 0.0 110.345 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.569 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 64.8 t80 -56.81 -48.98 76.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.532 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -56.95 -54.9 41.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.452 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.569 ' O ' HG13 ' A' ' 34' ' ' ILE . 59.9 m -53.05 -46.43 68.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.934 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.436 ' HA ' HD12 ' A' ' 34' ' ' ILE . 43.7 t80 -52.63 -48.07 66.63 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.002 0.429 . . . . 0.0 110.699 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 48.9 mt -59.97 -42.3 93.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.284 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.545 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.0 mm-40 -61.68 -31.79 71.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.18 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 30' ' ' SER . 68.0 mt -62.23 -55.81 21.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.429 . . . . 0.0 109.898 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.835 ' HB2' HD13 ' B' ' 6' ' ' LEU . 43.1 mt -60.58 -39.69 88.96 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.545 ' HB2' ' HA ' ' A' ' 33' ' ' GLU . 9.7 m-70 -58.07 -42.83 86.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.596 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.472 HG22 ' SD ' ' A' ' 53' ' ' MET . 89.4 m -59.65 -34.06 72.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.307 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.543 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 49.2 t80 -62.74 -62.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.208 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.575 ' CD ' HD23 ' B' ' 6' ' ' LEU . 16.8 mt-30 -60.26 -43.18 96.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.274 -179.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 59.7 mtpt -54.02 -41.23 67.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.692 0.282 . . . . 0.0 111.574 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 tp10 -71.47 -49.74 38.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 2.8 pt20 -60.95 -39.9 91.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -178.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 97.3 mt -57.78 134.06 55.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.998 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.45 ' HB2' ' O ' ' A' ' 43' ' ' LEU . 25.5 m170 76.8 48.67 0.06 Allowed 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.5 m -52.13 140.08 21.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.28 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 44' ' ' HIS . 34.5 mmtp -135.41 -54.59 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.994 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.32 -147.84 1.77 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.373 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.8 mtm105 -77.65 138.96 62.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.72 122.79 12.26 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.382 2.055 . . . . 0.0 111.789 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 63.89 122.29 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.04 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -177.89 -46.49 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.452 0.644 . . . . 0.0 111.079 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.75 -128.37 0.32 Allowed Glycine 0 C--N 1.311 -0.81 0 CA-C-N 114.757 -1.11 . . . . 0.0 113.064 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.472 ' SD ' HG22 ' A' ' 37' ' ' THR . 26.2 ttt -66.68 145.6 55.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.033 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 58' ' ' VAL . 20.6 t -159.02 -150.22 0.23 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -65.07 -32.23 73.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.898 0.38 . . . . 0.0 110.955 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 11.0 pt-20 -60.0 -50.11 75.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.793 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.497 ' O ' ' HB ' ' A' ' 60' ' ' THR . 29.9 tt0 -73.61 -47.31 41.21 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 54' ' ' SER . 97.5 t -53.38 -44.78 55.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.98 0.419 . . . . 0.0 110.294 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 36.5 t80 -61.34 -30.75 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.271 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 58.5 m -66.76 -62.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.399 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 57' ' ' GLU . 8.8 mp0 -57.06 -41.46 78.77 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 58' ' ' VAL . 99.3 t -63.65 -44.34 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.729 0.3 . . . . 0.0 110.428 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.702 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.29 -41.67 97.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 0.0 109.986 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -62.31 -41.96 98.97 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.844 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 34' ' ' ILE . 4.7 mt -63.51 -64.05 1.01 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.412 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.501 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.3 m-30 -73.61 38.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.613 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -62.72 130.68 46.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.825 0.345 . . . . 0.0 110.201 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.07 -44.3 3.11 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.72 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.452 HE21 ' HB2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -86.54 54.8 3.29 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.038 0.447 . . . . 0.0 110.309 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 70' ' ' GLU . 4.8 mm-40 -60.73 -3.76 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.493 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.1 -50.29 73.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.909 0.385 . . . . 0.0 110.587 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.529 HD13 HG12 ' A' ' 17' ' ' ILE . 85.9 mt -68.02 -36.1 79.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.21 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.702 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.37 -37.71 65.29 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.74 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 39.0 t -56.74 -42.28 79.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.877 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.47 -41.08 76.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.619 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 12.9 t80 -57.0 -43.25 81.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.81 -34.05 88.86 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.948 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 74' ' ' SER . 83.8 mt-30 -49.52 -49.95 43.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.707 0.289 . . . . 0.0 111.464 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -67.47 -41.29 84.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.995 0.426 . . . . 0.0 110.555 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 76' ' ' PHE . 66.6 mt -61.49 142.39 94.07 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.3 82.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.815 2.344 . . . . 0.0 112.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 84' ' ' LYS . 5.5 tp10 -59.45 139.3 57.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.239 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.36 -38.43 74.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.942 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.562 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -163.82 130.04 3.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.51 179.782 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.623 ' HA ' HH11 ' A' ' 85' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.947 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 19.5 p30 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.824 0.345 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.829 HG23 HD22 ' A' ' 35' ' ' LEU . 40.1 mm -61.37 -36.46 73.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.148 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.92 -39.3 39.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.318 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 56.7 mtm -71.14 -42.62 68.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.059 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.576 HD11 ' HD2' ' A' ' 13' ' ' TYR . 22.6 tp -65.33 -53.11 48.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.403 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.835 HD13 ' HB2' ' A' ' 35' ' ' LEU . 34.7 tp -57.85 -39.3 77.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 109.911 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -66.02 -36.64 83.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.744 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -57.44 -42.47 82.51 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.172 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.99 -45.85 78.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.995 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -59.46 -38.3 80.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.306 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.457 ' HD2' HD12 ' A' ' 11' ' ' ILE . 45.6 t80 -58.93 -54.99 40.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.306 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.86 -43.46 98.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.143 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' B' ' 9' ' ' ALA . 56.1 mt-10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.94 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.861 0.362 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.6 m -160.68 39.29 0.16 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -177.63 45.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.538 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -122.11 152.66 39.64 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.175 0.512 . . . . 0.0 111.323 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.576 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 96.0 t -61.35 -34.21 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.748 178.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 93.7 mt-10 -60.84 -36.93 80.37 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 11' ' ' ILE . 11.9 t80 -59.5 -58.31 9.16 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -65.39 -29.32 70.02 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.576 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.1 t-20 -58.06 -40.16 80.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.587 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.29 -46.12 57.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.676 179.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.558 HD13 ' CB ' ' B' ' 8' ' ' ALA . 35.0 mm -51.93 -45.52 40.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.095 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 92.9 p -56.97 -38.7 73.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.164 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.57 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 t80 -62.77 -54.8 33.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.961 0.41 . . . . 0.0 110.665 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.604 HG11 ' HA ' ' B' ' 9' ' ' ALA . 44.6 t -56.94 -39.85 68.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.99 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -58.44 -55.47 34.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.539 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 12' ' ' SER . 27.2 mtpp -53.03 -37.67 61.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.2 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' HD1' ' A' ' 21' ' ' PHE . 80.0 mt -62.02 -40.23 86.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.139 0.495 . . . . 0.0 110.231 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' B' ' 12' ' ' LEU . 41.3 ttmt -66.73 -54.0 27.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.902 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 16' ' ' LYS . 15.3 t -62.91 -32.27 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.87 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HG2' HH11 ' A' ' 20' ' ' ARG . 12.2 tpp85 -69.24 -49.15 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.072 0.463 . . . . 0.0 110.924 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 27' ' ' ILE . 17.8 m-85 -92.64 40.86 1.06 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.816 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 19' ' ' THR . 38.3 mt -61.56 -35.87 79.01 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -75.04 -37.97 61.56 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.976 0.417 . . . . 0.0 110.482 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CG1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -115.44 74.57 4.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.065 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.29 -29.78 80.42 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.575 2.183 . . . . 0.0 111.908 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -52.03 -30.98 27.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.813 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 21' ' ' PHE . 1.6 mm -63.77 -39.55 85.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.301 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.587 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 68.2 t80 -56.44 -48.14 77.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.578 ' HA ' HH11 ' A' ' 29' ' ' ARG . 4.2 mmm180 -56.51 -57.41 12.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.799 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.511 ' O ' HG13 ' A' ' 34' ' ' ILE . 32.5 p -48.82 -48.73 41.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.467 ' HA ' HD12 ' A' ' 34' ' ' ILE . 51.7 t80 -51.7 -47.41 63.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.071 0.462 . . . . 0.0 110.637 178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 28' ' ' TYR . 49.2 mt -58.61 -40.95 84.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.139 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 57.6 mm-40 -63.24 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.051 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.77 HD11 HD12 ' A' ' 65' ' ' LEU . 53.1 mt -62.9 -56.85 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-O 120.96 0.41 . . . . 0.0 110.244 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.709 HD22 HG23 ' B' ' 2' ' ' ILE . 72.1 mt -59.81 -37.3 78.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.55 ' O ' ' HG3' ' A' ' 40' ' ' LYS . 5.3 m-70 -62.29 -41.62 98.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.573 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.498 HG22 ' SD ' ' A' ' 53' ' ' MET . 99.3 m -61.72 -38.54 88.27 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.194 0.521 . . . . 0.0 109.853 179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.55 ' HB3' ' O ' ' A' ' 35' ' ' LEU . 30.5 t80 -54.47 -56.55 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.774 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.482 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 4.2 mm100 -58.38 -42.97 88.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.126 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.55 ' HG3' ' O ' ' A' ' 36' ' ' HIS . 28.8 mtpp -58.22 -54.91 41.67 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.93 -37.95 79.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.593 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.499 ' HG2' ' HG3' ' A' ' 49' ' ' PRO . 7.6 tt0 -54.68 -59.02 5.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.789 -179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -68.03 152.1 46.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.039 0.447 . . . . 0.0 111.988 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.523 ' CD2' ' H ' ' A' ' 45' ' ' THR . 0.1 OUTLIER -168.52 -51.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.361 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.523 ' H ' ' CD2' ' A' ' 44' ' ' HIS . 39.5 p -156.86 -152.51 0.37 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.6 0.238 . . . . 0.0 110.516 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.464 ' H ' ' HB ' ' A' ' 45' ' ' THR . 4.1 mptp? -73.74 175.14 7.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.755 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.21 137.83 0.13 Allowed Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.448 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.7 mtm105 -61.51 130.43 91.97 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.499 ' HG3' ' HG2' ' A' ' 42' ' ' GLN . 58.7 Cg_endo -71.13 143.58 44.66 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.071 2.514 . . . . 0.0 112.611 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -172.72 53.6 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.197 0.523 . . . . 0.0 110.538 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -154.31 -40.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.587 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.73 -133.18 0.52 Allowed Glycine 0 C--N 1.313 -0.741 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.985 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.498 ' SD ' HG22 ' A' ' 37' ' ' THR . 26.1 ttt -70.91 150.85 45.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.608 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.473 ' O ' HG23 ' A' ' 58' ' ' VAL . 80.3 p -156.99 -147.93 0.2 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.025 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.551 ' OE1' HD22 ' A' ' 80' ' ' LEU . 35.4 mm-40 -70.21 -28.4 65.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.522 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 22.6 pt-20 -55.22 -49.45 71.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.787 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 37.3 tp10 -74.92 -51.52 13.57 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.528 HG13 HG22 ' A' ' 34' ' ' ILE . 46.8 t -52.73 -44.12 46.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.165 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.582 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 25.2 t80 -62.41 -36.01 81.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.621 HG22 HD21 ' A' ' 64' ' ' ASN . 91.2 m -72.07 -50.97 23.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.937 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.422 ' OE1' ' HA ' ' A' ' 61' ' ' GLU . 4.6 tp10 -58.44 -45.79 87.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.01 -179.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.565 HG23 HG21 ' A' ' 34' ' ' ILE . 94.3 t -64.45 -43.03 96.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.627 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -60.45 -42.18 95.62 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.15 179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.621 HD21 HG22 ' A' ' 60' ' ' THR . 73.6 m-20 -59.2 -39.73 83.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.321 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.77 HD12 HD11 ' A' ' 34' ' ' ILE . 6.5 mt -68.49 -64.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.286 179.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 3.7 m-30 -74.18 41.65 0.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.65 -178.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -62.18 137.55 58.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.867 0.365 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.09 -45.01 3.25 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.323 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -88.02 52.88 2.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.064 0.459 . . . . 0.0 110.491 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.58 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 93.6 mt-10 -67.75 6.23 0.7 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.266 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -61.64 -48.98 78.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.174 0.511 . . . . 0.0 110.056 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.4 mt -72.32 -34.3 67.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.222 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.627 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -53.98 -38.16 64.73 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.993 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 41.7 t -55.11 -42.61 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.741 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.55 -45.84 78.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.592 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.582 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.7 t80 -57.54 -44.13 84.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.421 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.99 -41.9 98.44 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.709 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 74' ' ' SER . 73.7 mt-30 -52.57 -44.92 66.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.817 0.309 . . . . 0.0 111.646 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -64.32 -40.42 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.011 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.551 HD22 ' OE1' ' A' ' 55' ' ' GLU . 35.0 mt -65.39 130.08 94.58 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.223 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.468 ' HD2' ' HG3' ' A' ' 55' ' ' GLU . 47.9 Cg_endo -67.95 125.32 12.95 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.455 2.104 . . . . 0.0 112.116 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -92.26 44.23 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.816 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -173.73 133.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.389 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -74.91 -128.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.613 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.882 179.863 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.869 0.366 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.709 HG23 HD22 ' A' ' 35' ' ' LEU . 46.2 mm -67.64 -35.77 73.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -35.98 55.23 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 66.1 mtt -65.15 -47.33 77.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.528 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.513 HD23 ' HB1' ' A' ' 10' ' ' ALA . 80.2 mt -69.78 -45.7 67.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.959 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.482 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 56.0 tp -57.41 -44.35 84.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -72.53 -38.48 68.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.786 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.558 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -56.45 -41.77 77.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.209 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.604 ' HA ' HG11 ' A' ' 14' ' ' VAL . . . -55.05 -43.24 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.971 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.67 -38.04 89.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.428 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.429 ' CD2' HD12 ' A' ' 11' ' ' ILE . 42.0 t80 -57.13 -55.44 34.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.472 ' HB3' ' NZ ' ' A' ' 18' ' ' LYS . 95.9 mt -64.42 -49.29 72.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.526 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.196 179.683 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 2' ' ' SER . 35.9 tp10 . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.42 ' N ' ' HG3' ' A' ' 1' ' ' GLU . 80.5 p -61.57 131.25 49.48 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.715 0.293 . . . . 0.0 110.979 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.6 t70 63.19 119.04 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.997 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -66.65 142.52 57.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.121 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.555 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 99.0 t -58.44 -41.73 82.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.222 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 50.5 mt-10 -58.57 -39.48 80.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.446 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.491 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.7 t80 -58.93 -57.37 13.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.933 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.25 -31.83 73.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.9 t-20 -55.16 -41.28 71.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.658 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.755 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.84 -45.97 55.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.048 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.529 HD13 ' CB ' ' B' ' 8' ' ' ALA . 32.6 mm -52.94 -45.3 51.45 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.081 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.319 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -57.44 -36.25 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.191 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.514 ' O ' HG13 ' A' ' 17' ' ' ILE . 10.1 t80 -65.97 -53.16 42.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -59.04 -44.24 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.499 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.78 -59.9 4.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.197 0.522 . . . . 0.0 111.198 -179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HA ' HG22 ' A' ' 19' ' ' THR . 88.3 tttt -53.48 -38.63 63.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.711 -179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 13' ' ' TYR . 80.2 mt -62.37 -40.6 88.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.965 0.412 . . . . 0.0 110.214 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -63.91 -58.27 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 15.3 t -58.16 -31.45 67.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.475 -179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.7 tpt85 -64.74 -57.59 8.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.383 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.512 ' CD2' HG13 ' A' ' 27' ' ' ILE . 63.0 m-85 -92.98 40.66 1.06 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.392 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 19' ' ' THR . 62.9 mt -54.59 -34.77 62.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.816 0.341 . . . . 0.0 110.847 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -75.26 -39.22 60.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -105.72 78.87 0.48 Allowed Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.401 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.451 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 21.4 Cg_endo -59.26 -35.3 97.48 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.726 2.284 . . . . 0.0 112.46 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -50.8 -31.42 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.422 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.512 HG13 ' CD2' ' A' ' 21' ' ' PHE . 8.4 mm -64.27 -46.77 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 0.0 110.646 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 32' ' ' LEU . 51.4 t80 -56.76 -49.97 73.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.043 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -57.67 -53.39 58.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.719 -179.699 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 34' ' ' ILE . 60.9 m -51.89 -51.7 55.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.451 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -52.06 -49.0 64.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.053 0.454 . . . . 0.0 111.119 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 36' ' ' HIS . 80.4 mt -61.8 -42.13 98.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 57.7 mm-40 -61.03 -34.3 74.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.358 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.661 HG22 HG13 ' A' ' 58' ' ' VAL . 86.4 mt -61.99 -60.64 2.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.175 0.512 . . . . 0.0 110.45 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.468 HD23 HG11 ' A' ' 58' ' ' VAL . 89.8 mt -57.93 -37.97 75.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.635 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.53 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.47 -43.34 99.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.13 179.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.516 ' HA ' ' HZ2' ' A' ' 40' ' ' LYS . 89.2 m -56.91 -43.09 81.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.144 0.497 . . . . 0.0 110.406 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.576 ' HD2' HG21 ' B' ' 2' ' ' ILE . 42.9 t80 -65.84 -55.83 15.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.948 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.452 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 3.0 tp-100 -59.6 -48.87 79.99 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.322 -0.854 . . . . 0.0 113.056 -178.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.518 ' HB2' ' NZ ' ' A' ' 40' ' ' LYS . 10.4 mtmp? -52.38 -50.21 62.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.643 0.258 . . . . 0.0 111.346 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.414 ' OE1' ' HG2' ' A' ' 53' ' ' MET . 55.6 mt-10 -68.14 -36.82 80.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.9 0.381 . . . . 0.0 110.664 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.38 -39.91 84.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.913 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 39' ' ' GLN . 96.5 mt -54.06 -39.87 66.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.421 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -167.51 137.56 2.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.994 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.9 p -77.18 56.58 1.31 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.785 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -126.86 120.83 30.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.721 0.296 . . . . 0.0 110.883 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.78 -144.86 10.99 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.782 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 57.0 mtt85 -88.13 147.05 39.6 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.631 0.253 . . . . 0.0 111.112 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.21 144.72 46.83 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.77 2.313 . . . . 0.0 112.08 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' A' ' 53' ' ' MET . 10.7 t80 -155.04 144.84 21.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.67 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.748 ' H ' HH11 ' A' ' 51' ' ' ARG . 0.0 OUTLIER -77.08 51.53 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.412 -179.217 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.06 151.75 2.91 Favored Glycine 0 C--N 1.322 -0.229 0 CA-C-N 115.694 -0.685 . . . . 0.0 113.392 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.566 ' SD ' ' HG2' ' A' ' 57' ' ' GLU . 16.9 tpt -153.68 135.56 14.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.539 -0.33 . . . . 0.0 110.616 -179.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.505 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 78.9 p -167.41 -149.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.148 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -68.77 -33.21 73.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.406 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG2' ' OG ' ' A' ' 54' ' ' SER . 15.5 pt-20 -56.27 -46.04 79.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.43 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.566 ' HG2' ' SD ' ' A' ' 53' ' ' MET . 34.9 tp10 -68.42 -53.25 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.661 HG13 HG22 ' A' ' 34' ' ' ILE . 37.6 t -53.25 -44.37 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.159 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 26.1 t80 -59.96 -37.81 80.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.326 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.525 HG22 HD21 ' A' ' 64' ' ' ASN . 92.7 m -72.31 -51.1 22.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.721 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -58.28 -48.17 81.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.485 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.554 HG23 HG21 ' A' ' 34' ' ' ILE . 95.4 t -64.12 -42.12 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.887 0.375 . . . . 0.0 110.237 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.811 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.13 -40.1 92.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.019 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.525 HD21 HG22 ' A' ' 60' ' ' THR . 64.5 m-20 -58.79 -40.45 84.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.457 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.533 HD11 ' CB ' ' A' ' 30' ' ' SER . 6.1 mt -68.29 -62.85 1.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.122 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HB2' HD22 ' A' ' 73' ' ' LEU . 5.1 m-30 -74.82 41.41 0.16 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.669 -179.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -64.02 133.47 53.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.718 0.294 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.34 -42.09 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.242 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -81.03 56.0 2.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 54.4 mt-10 -60.01 -4.57 0.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.073 -179.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.38 -53.82 51.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.939 0.4 . . . . 0.0 110.244 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.1 mt -71.56 -33.64 69.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.417 0.627 . . . . 0.0 109.509 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -53.85 -38.72 64.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.996 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.2 t -57.8 -42.23 83.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.929 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 59.8 mm-40 -62.71 -53.95 46.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.728 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.491 ' HE2' ' HA ' ' A' ' 59' ' ' PHE . 22.2 t80 -58.74 -38.97 79.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.2 0.524 . . . . 0.0 110.868 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.19 -49.46 72.06 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.396 -0.82 . . . . 0.0 114.111 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 21.4 pt20 -56.96 -37.01 70.98 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.267 0.533 . . . . 0.0 111.295 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.501 ' HD1' ' HG3' ' A' ' 78' ' ' GLN . 2.8 m-85 -58.17 -48.11 81.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.953 0.406 . . . . 0.0 110.445 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.44 HD11 ' CZ ' ' A' ' 76' ' ' PHE . 46.7 mt -75.77 144.28 76.32 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.503 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.04 136.46 73.13 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.55 2.167 . . . . 0.0 112.178 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 64.44 118.87 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.932 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -179.58 134.75 0.12 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.07 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.653 ' O ' ' HD2' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -173.66 141.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.153 179.681 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.412 HH11 ' HG3' ' A' ' 85' ' ' ARG . 32.5 tpt85 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.932 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.47 ' O ' ' HB ' ' B' ' 2' ' ' ILE . 15.3 p-10 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.54 0.209 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.576 HG21 ' HD2' ' A' ' 38' ' ' TYR . 32.1 mm 72.04 -37.67 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.833 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . 0.427 ' HB2' HE21 ' B' ' 3' ' ' GLN . 0.0 OUTLIER -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.089 0.471 . . . . 0.0 109.816 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 60.2 mtm -59.12 -41.88 89.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.523 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.755 HD23 ' HB1' ' A' ' 10' ' ' ALA . 54.9 mt -71.02 -46.27 62.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.099 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.513 HD11 ' N ' ' A' ' 36' ' ' HIS . 3.3 mm? -57.5 -42.66 83.16 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.287 0.565 . . . . 0.0 109.77 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.34 -40.08 85.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.918 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.529 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.42 -46.13 83.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.584 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.425 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -56.5 -43.47 79.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -39.3 93.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.72 -57.73 9.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.494 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.77 -47.87 84.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.347 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.865 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.606 0.241 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.3 m 53.57 -149.01 0.43 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.185 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.32 -138.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.982 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t -64.55 153.08 40.23 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.578 0.704 . . . . 0.0 112.298 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.65 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 58.9 t -55.43 -36.42 41.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.942 178.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.7 -39.71 81.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.307 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.454 ' O ' HG12 ' A' ' 11' ' ' ILE . 12.9 t80 -60.8 -56.44 21.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.35 -179.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.54 -34.6 78.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.65 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 5.6 t-20 -58.74 -37.0 75.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.578 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.815 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.31 -41.99 65.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.734 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.759 HD13 ' HB1' ' B' ' 8' ' ' ALA . 44.7 mm -53.75 -44.18 58.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.324 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.4 p -56.44 -36.21 68.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.01 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.1 t80 -66.9 -55.54 14.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.887 0.375 . . . . 0.0 110.841 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.0 t -60.0 -44.52 94.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.3 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -60.39 -53.88 52.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.957 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' O ' HG22 ' A' ' 19' ' ' THR . 87.7 tttt -53.72 -38.52 64.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.94 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 13' ' ' TYR . 90.0 mt -61.39 -36.59 74.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.807 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.551 ' HB2' ' NZ ' ' A' ' 18' ' ' LYS . 5.2 ttmp? -64.8 -51.87 59.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.83 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -67.43 -29.3 68.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.646 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -64.54 -62.05 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.573 ' CD2' HG13 ' A' ' 27' ' ' ILE . 49.1 m-85 -94.83 44.66 1.1 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.849 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 19' ' ' THR . 80.3 mt -53.53 -35.99 61.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 111.063 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -75.19 -35.91 61.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.096 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.425 ' HB3' HG12 ' A' ' 27' ' ' ILE . 92.5 m-70 -106.15 78.56 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.365 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.48 -34.52 98.13 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.82 2.347 . . . . 0.0 112.417 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -51.79 -32.46 31.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.692 HG23 HD22 ' A' ' 65' ' ' LEU . 10.4 mm -64.5 -48.96 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.664 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.457 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 61.6 t80 -58.44 -50.01 75.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.995 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -59.53 -56.65 19.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.343 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.632 ' O ' HG13 ' A' ' 34' ' ' ILE . 46.8 t -44.81 -51.91 9.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.528 -179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' HA ' HD12 ' A' ' 34' ' ' ILE . 47.9 t80 -50.36 -47.11 56.24 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.085 0.469 . . . . 0.0 110.779 179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' B' ' 9' ' ' ALA . 52.0 mt -63.26 -38.9 92.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.07 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 5.2 tp10 -64.69 -30.26 71.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.833 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.632 HG13 ' O ' ' A' ' 30' ' ' SER . 56.3 mt -63.78 -58.21 8.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.072 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.496 HD22 HG23 ' B' ' 2' ' ' ILE . 79.1 mt -57.44 -36.25 71.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.473 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 2.2 m-70 -62.01 -48.27 81.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.4 m -54.79 -43.79 73.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.477 ' HA ' ' SD ' ' A' ' 53' ' ' MET . 5.7 t80 -50.81 -40.76 56.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -75.35 -38.67 59.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.282 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 47.6 mmtm -61.18 -56.39 21.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.68 50.79 1.38 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.647 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -145.3 -52.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 0.0 111.252 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.428 ' O ' ' HD2' ' A' ' 44' ' ' HIS . 95.8 mt -83.62 37.39 0.58 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.575 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.428 ' HD2' ' O ' ' A' ' 43' ' ' LEU . 60.2 m170 -135.86 126.59 27.3 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.3 p -138.0 133.4 33.59 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.699 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.453 ' HA ' ' HD2' ' A' ' 46' ' ' LYS . 15.9 tptm -176.68 47.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.124 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.4 -145.09 5.88 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.274 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 75.0 mtt-85 -73.78 138.24 76.8 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.584 0.231 . . . . 0.0 110.766 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.18 129.56 33.59 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.575 2.184 . . . . 0.0 112.248 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -177.82 140.45 0.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.734 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -55.44 -37.88 68.27 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.408 0.623 . . . . 0.0 111.093 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.92 -46.55 2.4 Favored Glycine 0 C--N 1.315 -0.62 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.262 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 38' ' ' TYR . 28.1 ttt -160.97 150.41 16.97 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.002 0.43 . . . . 0.0 111.438 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.495 ' O ' HG23 ' A' ' 58' ' ' VAL . 80.7 p -164.91 -142.19 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.307 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -29.59 69.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.852 0.358 . . . . 0.0 110.733 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -56.29 -49.37 74.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.12 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.468 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 41.4 tp10 -75.76 -49.49 18.03 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.512 HG13 HG22 ' A' ' 34' ' ' ILE . 50.5 t -52.78 -43.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.172 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.573 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 28.5 t80 -62.22 -36.14 81.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.601 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.543 HG22 HD21 ' A' ' 64' ' ' ASN . 87.7 m -72.84 -51.64 18.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.038 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.507 ' CD ' HG12 ' A' ' 34' ' ' ILE . 74.9 tt0 -57.8 -45.11 86.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.884 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.588 HG23 HG21 ' A' ' 34' ' ' ILE . 98.7 t -64.27 -42.74 96.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.799 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -59.83 -41.93 92.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.116 178.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.543 HD21 HG22 ' A' ' 60' ' ' THR . 71.8 m-20 -60.38 -39.94 89.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.232 179.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.692 HD22 HG23 ' A' ' 27' ' ' ILE . 1.2 mt -62.93 -64.99 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.909 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 15.1 m-30 -74.76 42.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.812 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 -59.18 129.64 43.09 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.59 -42.5 2.94 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.901 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 69' ' ' GLN . 0.6 OUTLIER -81.52 50.5 1.49 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.811 0.338 . . . . 0.0 110.527 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.541 ' HA ' ' HB2' ' A' ' 73' ' ' LEU . 51.2 mt-10 -61.6 -1.15 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.47 -47.79 84.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.109 0.48 . . . . 0.0 110.422 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.0 mt -71.98 -35.39 69.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.267 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.799 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -54.05 -39.85 66.6 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.157 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 39.7 t -54.59 -41.06 69.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.943 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -70.2 -45.35 66.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.166 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.597 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 21.3 t80 -57.14 -45.32 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.275 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -43.2 94.3 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.865 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 74' ' ' SER . 72.9 mt-30 -56.06 -43.82 78.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.78 0.324 . . . . 0.0 111.144 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -62.11 -41.75 98.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.065 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.521 ' CD2' HD11 ' B' ' 2' ' ' ILE . 95.0 mt -64.36 136.77 96.89 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.944 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.86 47.67 2.01 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.741 2.294 . . . . 0.0 112.639 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -61.33 -44.39 97.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.22 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 65.95 143.21 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -156.64 142.95 18.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.0 0.429 . . . . 0.0 111.162 -179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.535 ' C ' ' HD3' ' A' ' 85' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.17 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.514 HD22 ' N ' ' B' ' 1' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.873 0.368 . . . . 0.0 111.635 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.521 HD11 ' CD2' ' A' ' 80' ' ' LEU . 24.7 mm 72.95 -39.08 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.527 0.078 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.975 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' B' ' 4' ' ' MET . 7.2 pt20 -56.77 -36.5 69.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.036 0.446 . . . . 0.0 110.233 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . 0.573 ' N ' ' HG3' ' B' ' 3' ' ' GLN . 18.1 ptt? -62.82 -46.15 89.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.452 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.815 HD23 ' HB1' ' A' ' 10' ' ' ALA . 85.0 mt -68.93 -43.76 74.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.16 0.505 . . . . 0.0 110.358 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.7 tp -60.99 -44.57 97.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.612 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -73.38 -35.17 65.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.644 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.759 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -54.11 -39.99 66.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.214 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -59.13 -43.0 91.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.384 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.22 -50.67 72.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.946 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -59.24 -58.16 9.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.339 0.59 . . . . 0.0 111.163 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 21.9 tp -55.65 -39.17 70.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.699 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.804 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.1 m -164.02 -43.49 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.712 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -78.76 48.62 0.83 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.315 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.87 143.98 24.21 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.46 0.648 . . . . 0.0 112.143 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.628 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 56.7 t -55.6 -40.3 58.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.381 178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 52.3 mt-10 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.449 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.569 ' O ' HG12 ' A' ' 11' ' ' ILE . 14.7 t80 -60.54 -54.71 42.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.727 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -32.59 74.31 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.49 0.662 . . . . 0.0 109.271 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.628 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 32.9 t-20 -54.46 -44.2 72.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.654 -1.157 . . . . 0.0 109.569 179.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB1' HD23 ' B' ' 5' ' ' LEU . . . -72.88 -43.72 62.19 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.066 179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.923 HG23 HD11 ' B' ' 12' ' ' LEU . 50.2 mm -51.29 -48.23 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.444 -179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.1 p -55.33 -36.5 66.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.104 -179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 27.6 t80 -62.2 -49.32 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.034 0.445 . . . . 0.0 109.942 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.462 HG11 ' HA ' ' B' ' 9' ' ' ALA . 24.4 t -66.28 -37.69 80.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -64.87 -44.44 89.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.335 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HA ' HG22 ' A' ' 19' ' ' THR . 53.9 tttp -66.99 -40.09 87.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.908 0.385 . . . . 0.0 110.701 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.537 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 80.1 mt -60.81 -43.06 94.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HB2' ' CE1' ' A' ' 28' ' ' TYR . 39.1 ttpt -65.44 -54.62 25.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.88 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.607 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.8 t -60.0 -29.37 68.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.317 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 20' ' ' ARG . 13.1 tpp85 -65.43 -56.99 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.171 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.5 m-85 -94.94 43.11 1.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.079 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 19' ' ' THR . 70.3 mt -55.4 -34.97 64.84 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.844 0.355 . . . . 0.0 110.921 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -74.66 -38.68 62.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.488 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -105.77 78.16 0.45 Allowed Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.22 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.91 -30.69 93.78 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.655 2.237 . . . . 0.0 112.266 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -52.58 -34.01 48.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.922 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.586 HG13 ' CD2' ' A' ' 21' ' ' PHE . 5.5 mm -64.76 -48.47 84.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.455 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.477 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 11.1 t80 -57.95 -57.24 13.66 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.063 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.847 HH21 HD12 ' A' ' 32' ' ' LEU . 2.0 mmp_? -50.12 -54.47 20.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.311 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 34' ' ' ILE . 69.4 m -53.57 -51.42 63.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.565 -179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.53 ' HA ' HD12 ' A' ' 34' ' ' ILE . 37.5 t80 -53.21 -51.01 63.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.965 0.412 . . . . 0.0 110.916 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.847 HD12 HH21 ' A' ' 29' ' ' ARG . 38.8 mt -59.81 -37.18 78.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.103 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 5.0 mm-40 -66.18 -31.27 72.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.805 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 30' ' ' SER . 82.8 mt -61.61 -56.73 15.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.459 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.682 HD22 HG23 ' B' ' 2' ' ' ILE . 73.2 mt -60.25 -39.15 85.74 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.538 ' O ' ' HB2' ' A' ' 40' ' ' LYS . 0.7 OUTLIER -61.14 -38.7 87.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.169 178.676 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.492 HG22 ' SD ' ' A' ' 53' ' ' MET . 76.1 m -62.68 -38.45 90.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.362 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.61 ' HE1' ' HA ' ' A' ' 54' ' ' SER . 31.5 t80 -59.71 -64.09 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.408 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.53 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 3.2 mm100 -60.02 -43.17 95.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.095 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 36' ' ' HIS . 15.4 ttmm -58.05 -45.81 86.42 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.803 0.335 . . . . 0.0 110.719 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -80.19 38.39 0.41 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.408 ' HB3' ' O ' ' A' ' 39' ' ' GLN . 8.0 tt0 -124.25 -33.2 3.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.763 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.2 mt -74.26 60.98 0.85 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.269 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -148.44 37.58 0.84 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.84 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.9 p 48.79 -139.63 0.75 Allowed 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.41 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -133.25 16.44 4.1 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.8 0.333 . . . . 0.0 110.575 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.73 -42.05 62.63 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.153 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' NH1' ' HB3' ' A' ' 48' ' ' ARG . 13.2 mtp-105 -57.89 140.97 81.25 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.641 0.258 . . . . 0.0 111.04 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -66.64 134.89 36.84 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.872 2.381 . . . . 0.0 112.698 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.6 t80 64.95 142.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.294 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HG3' HH11 ' A' ' 51' ' ' ARG . 40.5 ttt85 -65.71 -2.06 3.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.189 0.519 . . . . 0.0 111.017 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 56.17 -126.79 41.66 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.88 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.492 ' SD ' HG22 ' A' ' 37' ' ' THR . 25.3 ttt -72.85 143.32 47.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.245 -0.477 . . . . 0.0 110.899 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.61 ' HA ' ' HE1' ' A' ' 38' ' ' TYR . 34.6 t -161.29 -64.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.0 0.428 . . . . 0.0 111.737 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.499 ' OE1' ' HD2' ' A' ' 81' ' ' PRO . 48.7 mt-10 -144.09 -38.96 0.29 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.241 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 57' ' ' GLU . 10.5 pt-20 -59.97 -51.33 70.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 21.8 tt0 -72.69 -41.94 64.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.319 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.578 HG12 ' HZ ' ' A' ' 76' ' ' PHE . 46.7 t -55.46 -45.59 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.038 0.447 . . . . 0.0 110.357 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.589 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 29.0 t80 -65.75 -41.9 91.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.668 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.3 m -62.46 -48.5 79.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.936 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.712 ' HA ' ' ND2' ' A' ' 64' ' ' ASN . 5.1 mm-40 -59.03 -52.45 65.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.639 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.01 -45.33 94.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.394 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.793 ' HA ' HD21 ' A' ' 73' ' ' LEU . . . -61.4 -43.75 98.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.536 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.712 ' ND2' ' HA ' ' A' ' 61' ' ' GLU . 2.0 p30 -61.65 -38.68 88.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.84 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.503 HD22 HG23 ' A' ' 27' ' ' ILE . 1.8 mt -61.33 -63.27 1.34 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.631 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' CD2' ' A' ' 73' ' ' LEU . 7.5 m-30 -75.87 43.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.473 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.3 tpt180 -59.88 136.83 58.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.805 0.336 . . . . 0.0 110.662 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.73 -45.12 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.98 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -85.05 55.91 3.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.969 0.414 . . . . 0.0 110.407 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.13 -0.31 2.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.13 -43.73 98.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 110.733 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.31 -36.46 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.373 0.606 . . . . 0.0 110.353 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.793 HD21 ' HA ' ' A' ' 63' ' ' ALA . 0.4 OUTLIER -56.13 -36.83 68.68 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.268 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 40.3 t -53.12 -41.18 64.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.594 179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -73.01 -39.82 65.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.835 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.642 ' HB2' ' OH ' ' A' ' 13' ' ' TYR . 13.2 t80 -57.18 -43.18 82.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.811 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.52 -36.27 92.95 Favored Glycine 0 N--CA 1.453 -0.231 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.923 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 74' ' ' SER . 25.4 mt-30 -52.08 -47.65 65.08 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.735 0.302 . . . . 0.0 111.192 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -68.36 -44.52 75.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.526 HD11 ' CE2' ' A' ' 76' ' ' PHE . 85.1 mt -62.94 125.5 86.81 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.841 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.499 ' HD2' ' OE1' ' A' ' 55' ' ' GLU . 11.7 Cg_exo -69.17 119.96 6.88 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.389 2.059 . . . . 0.0 112.001 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 179.34 -48.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.819 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 56.4 -143.65 0.7 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.995 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.594 ' NZ ' ' HB3' ' A' ' 84' ' ' LYS . 5.8 ttpm? 64.33 141.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.029 0.442 . . . . 0.0 111.255 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.436 HH11 ' HG2' ' A' ' 85' ' ' ARG . 11.7 tpt180 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.863 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 22.8 p30 . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.125 0.012 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.682 HG23 HD22 ' A' ' 35' ' ' LEU . 43.9 mm -53.33 -35.5 24.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.776 0.322 . . . . 0.0 110.736 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -54.97 -39.67 69.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 57.5 mtp -64.58 -48.37 75.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.483 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.76 HD23 ' HB1' ' A' ' 10' ' ' ALA . 83.9 mt -65.89 -45.88 80.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.961 0.41 . . . . 0.0 110.671 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.53 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 57.1 tp -59.02 -48.29 82.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -64.1 -36.2 83.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.268 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.616 ' HB1' HD13 ' A' ' 11' ' ' ILE . . . -56.4 -50.63 71.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.558 ' HB2' HD22 ' A' ' 32' ' ' LEU . . . -46.55 -44.9 18.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.214 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.14 -39.72 91.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.064 0.459 . . . . 0.0 110.479 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.54 ' HD2' HD12 ' B' ' 12' ' ' LEU . 74.2 t80 -60.29 -51.43 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.517 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.923 HD11 HG23 ' A' ' 11' ' ' ILE . 6.5 mp -63.13 -48.67 77.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.681 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' B' ' 9' ' ' ALA . 16.9 pt-20 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.918 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.504 0.193 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.45 ' HB2' ' HB2' ' A' ' 8' ' ' ASN . 52.8 m -63.71 134.74 55.9 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.727 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.46 -66.68 0.54 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.22 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.87 140.65 53.23 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.097 0.475 . . . . 0.0 111.211 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.535 ' O ' ' HB2' ' A' ' 9' ' ' ASN . 94.7 t -65.9 -43.63 92.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.289 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 9' ' ' ASN . 52.1 mt-10 -58.47 -39.21 79.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.55 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.607 ' O ' HG12 ' A' ' 11' ' ' ILE . 19.0 t80 -59.76 -56.33 23.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.781 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.45 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 0.9 OUTLIER -65.06 -31.71 73.06 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.564 0.697 . . . . 0.0 109.23 178.563 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.535 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 36.8 t-20 -55.57 -43.42 75.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.554 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.02 65.76 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.715 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 7' ' ' PHE . 42.0 mm -52.75 -45.21 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.127 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.7 p -57.93 -35.28 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 76' ' ' PHE . 29.7 t80 -62.86 -51.91 65.18 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -62.07 -42.03 93.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.416 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -60.41 -44.72 95.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.35 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HA ' HG22 ' A' ' 19' ' ' THR . 62.3 tttp -67.79 -40.32 83.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.778 0.323 . . . . 0.0 110.607 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 13' ' ' TYR . 76.4 mt -59.93 -40.96 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.306 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.24 -56.35 17.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.708 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 14.5 t -62.36 -29.5 70.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.85 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 tpt85 -65.91 -60.12 3.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.816 0.341 . . . . 0.0 111.309 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CD2' HG13 ' A' ' 27' ' ' ILE . 62.8 m-85 -92.25 41.61 1.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.105 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 19' ' ' THR . 69.8 mt -53.49 -35.03 60.15 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.841 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.27 -37.48 60.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.027 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -106.63 78.17 0.53 Allowed Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.271 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -58.95 -36.32 97.04 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.726 2.284 . . . . 0.0 112.528 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -50.5 -31.0 14.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.266 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 21' ' ' PHE . 10.2 mm -64.33 -48.01 87.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.133 0.492 . . . . 0.0 110.471 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.624 ' CE2' HD11 ' A' ' 32' ' ' LEU . 57.6 t80 -62.64 -48.79 77.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.133 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -54.98 -54.81 38.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.561 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.714 ' HB3' HD11 ' A' ' 65' ' ' LEU . 47.5 t -54.06 -44.11 70.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.821 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.462 ' HA ' HD12 ' A' ' 34' ' ' ILE . 60.3 t80 -55.26 -46.4 76.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.909 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.624 HD11 ' CE2' ' A' ' 28' ' ' TYR . 69.6 mt -62.81 -47.25 84.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.898 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 30' ' ' SER . 24.6 pt-20 -62.69 -24.48 67.67 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.406 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 30' ' ' SER . 93.5 mt -66.94 -57.43 10.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.408 HD22 HG23 ' B' ' 2' ' ' ILE . 91.5 mt -58.79 -40.05 82.89 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 121.525 0.679 . . . . 0.0 109.413 178.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 40' ' ' LYS . 3.8 m-70 -61.86 -49.13 77.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.23 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.487 HG22 ' SD ' ' A' ' 53' ' ' MET . 37.1 m -52.17 -42.03 63.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.796 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.471 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 47.9 t80 -54.07 -44.07 70.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.108 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.591 ' HG3' ' CD2' ' B' ' 6' ' ' LEU . 3.4 mm100 -73.04 -39.59 65.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.114 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 36' ' ' HIS . 32.0 mmmt -56.47 -67.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 45' ' ' THR . 21.3 pt-20 -80.86 37.88 0.44 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.471 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 7.3 tt0 -95.43 -44.1 7.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.0 mt -52.34 -47.66 65.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.331 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -175.86 46.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.97 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.616 ' HA ' ' HB2' ' A' ' 41' ' ' GLU . 82.0 p 57.07 130.2 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.2 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 45' ' ' THR . 32.0 mmmt -146.93 136.75 23.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.649 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.89 -104.28 1.37 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.67 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.9 mtt-85 -51.24 139.27 25.79 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 111.591 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.552 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 34.8 Cg_endo -63.37 -154.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.009 2.473 . . . . 0.0 112.555 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.552 ' HB3' ' O ' ' A' ' 49' ' ' PRO . 10.8 t80 84.01 141.72 0.06 Allowed 'General case' 0 C--O 1.232 0.179 0 O-C-N 123.692 0.62 . . . . 0.0 110.612 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -77.9 52.97 1.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.507 0.67 . . . . 0.0 111.799 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.98 123.59 1.96 Allowed Glycine 0 C--N 1.316 -0.546 0 CA-C-N 114.922 -1.035 . . . . 0.0 113.67 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.747 ' HG3' ' HB3' ' A' ' 57' ' ' GLU . 11.6 ttt -87.15 144.89 26.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.204 -0.498 . . . . 0.0 110.639 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.705 ' O ' HG23 ' A' ' 58' ' ' VAL . 79.5 p -145.81 -154.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.025 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -58.53 -38.27 77.39 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.233 -179.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -57.56 -46.01 84.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.541 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.747 ' HB3' ' HG3' ' A' ' 53' ' ' MET . 10.9 tt0 -73.64 -44.17 57.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.764 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 54' ' ' SER . 55.6 t -53.14 -47.54 55.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.766 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.567 ' HA ' ' HE2' ' A' ' 76' ' ' PHE . 30.6 t80 -63.81 -32.36 73.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.7 m -66.49 -58.3 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.942 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' OE1' HG23 ' A' ' 34' ' ' ILE . 56.0 mt-10 -57.1 -45.21 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.337 -179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.581 HG23 HG21 ' A' ' 34' ' ' ILE . 97.5 t -64.57 -42.78 96.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.628 0.251 . . . . 0.0 110.634 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.86 95.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.911 0.386 . . . . 0.0 110.3 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -58.69 -39.62 81.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.131 179.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.714 HD11 ' HB3' ' A' ' 30' ' ' SER . 3.5 mt -67.45 -59.9 3.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.66 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.448 ' HZ ' HD13 ' A' ' 17' ' ' ILE . 4.6 m-30 -70.92 35.2 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.646 -1.161 . . . . 0.0 112.187 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 65' ' ' LEU . 38.5 ttm180 -63.1 119.86 10.34 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.08 -39.77 3.05 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.999 -179.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.486 ' H ' ' NE2' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -83.94 53.05 2.45 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.958 0.408 . . . . 0.0 110.396 179.479 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -60.71 -7.11 2.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.019 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.657 ' OD1' ' HG ' ' A' ' 72' ' ' LEU . 1.7 p30 -64.08 -48.94 74.23 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.71 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.657 ' HG ' ' OD1' ' A' ' 71' ' ' ASP . 78.6 mt -72.3 -44.6 62.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.615 0.722 . . . . 0.0 109.46 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tp -52.45 -36.73 55.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.441 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.485 ' O ' ' HG3' ' A' ' 78' ' ' GLN . 45.5 t -55.83 -44.3 77.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.582 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -66.57 -42.09 87.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.433 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.612 ' HZ ' HG12 ' A' ' 58' ' ' VAL . 19.9 t80 -58.07 -44.95 87.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.68 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.42 -36.67 93.46 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.898 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 74' ' ' SER . 76.0 mt-30 -52.78 -47.64 67.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.624 0.249 . . . . 0.0 111.343 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.84 -45.01 83.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.833 0.349 . . . . 0.0 110.797 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.731 HD21 HD11 ' B' ' 2' ' ' ILE . 68.4 mt -66.26 133.3 94.53 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.928 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.79 123.93 10.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.248 1.965 . . . . 0.0 112.075 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -84.37 50.26 1.84 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.082 0.468 . . . . 0.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.32 -140.5 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.516 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.56 ' NZ ' ' HB3' ' A' ' 84' ' ' LYS . 6.2 ttpm? -61.1 143.72 54.91 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.138 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.907 -179.967 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ASN . . . . . 0.519 HD22 ' N ' ' B' ' 1' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.686 0.279 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.731 HD11 HD21 ' A' ' 80' ' ' LEU . 43.3 mm 72.97 -36.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.226 -0.146 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.208 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . 0.426 ' H ' ' C ' ' B' ' 1' ' ' ASN . 17.3 tp60 -64.45 -46.01 84.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.175 0.512 . . . . 0.0 109.824 178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 49.9 mtm -72.41 -41.89 65.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.975 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.481 HD11 ' HD2' ' A' ' 13' ' ' TYR . 21.8 tp -64.23 -48.24 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.591 ' CD2' ' HG3' ' A' ' 39' ' ' GLN . 36.9 tp -59.96 -45.33 93.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.088 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -63.99 -33.28 75.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.306 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.59 ' CB ' HD13 ' A' ' 11' ' ' ILE . . . -57.18 -44.03 83.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.578 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -46.5 75.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 34.5 t70 -60.08 -35.95 76.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.375 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' TYR . . . . . 0.442 ' HD2' HD12 ' A' ' 11' ' ' ILE . 61.9 t80 -65.15 -47.54 76.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.136 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.37 23.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.637 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 11' ' ' TYR . 4.2 tm-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.547 -179.971 . . . . . . . . 1 1 . 1 stop_ save_